ISOEUGENOL, N° CAS : 97-54-1 - Isoeugénol, Origine(s) : Naturelle, Synthétique, Autre langue : Isoeugenolo. Nom INCI : ISOEUGENOL, Nom chimique : Phenol, 2-methoxy-4-(1-propenyl)- ,N° EINECS/ELINCS : 202-590-7. Noms français : Iso-Eugénol ; Méthoxy-2 (propènyl-1)-4 phénol. Noms anglais : Isoeugenol; Phenol, 2-methoxy-4-(1-propenyl)-

Isododecane is a branched chain aliphatic hydrocarbon with 12 carbons; used as a solvent.
Isododecane is a colorless liquid that is commonly found in many cosmetic, hair care, and skincare products.
Isododecane is a branched chain of twelve carbons and twenty-six hydrocarbons.


CAS Number: 31807-55-3 / 93685-81-5 / 13475-82-6
EC Number: 250-816-8 / 297-629-8 / 236-757-0
Chem/IUPAC Name: 2,2,4,6,6-Pentamethylheptane
Molecular Formula : C12H26


Isododecane is a safe, non-irritating cosmetic-grade solvent and emollient with low viscosity, good volatility, spreadability, and drying time.
Isododecane is a synthetic aliphatic hydrocarbon with a branched structure.
Isododecane is a relatively inert, colorless, odorless ingredient suitable for almost all types of skin, hair, sun, and lip care preparations.


Thanks to good solubilizing properties, Isododecane is suitable for cleansing applications which eliminate oil, dirt, and impurities from the skin's surface and effectively remove decorative cosmetics.
Isododecane is compatible and completely soluble with silicones, hydrocarbons, isoparaffin, and mineral spirits.


Isododecane has a low density and low viscosity.
Isododecane is a colorless liquid that is commonly found in many cosmetic, hair care, and skincare products.
Isododecane is a branched chain of twelve carbons and twenty-six hydrocarbons.


Isododecane is a branched chain aliphatic hydrocarbon with 12 carbons.
Isododecane is a hydrocarbon that is most often used as an emollient and solvent in skin care products.
Isododecane is an important raw material for various industries.


In the cosmetics and personal care industry Isododecane has several critical functions.
In addition to its qualities such as excellent spreadability and smoothness on the skin, Isododecane is an important alternative to cyclosiloxanes (D4 and D5), the use of which have been strictly regulated by the EU since 2020.


The chemical formula of Isododecane is C12H26.
It has long been made via petroleum resources but with increasing awareness, the industry is rapidly moving towards making plant-based and natural Isododecane.


This is achieved by converting starch and sugar residues and forestry waste into isobutene.
This isobutene is then converted into Isododecane.
Isododecane is a branched-chain aliphatic hydrocarbon with 12 carbon atoms.


Isododecane is colorless liquid with excellent spreadability.
Isododecane is not soluble in water but soluble in silicones, fats, and isoparaffins, etc.
Isododecane is derived from petroleum products.


Isododecane is a clear, colorless, viscous,synthetic liquid.
Isododecane's also free from dyes and preservatives.
Isododecane can be added to formulas as is, add to oil phase, use level 2-15%.


Isododecane is stable when kept in a closed container at a cool & dry place.
Isododecane is an ultra-lightweight Emollient.
Isododecane can quickly evaporate from the skin.


Does not clog pores Makes Isododecane not leave a sticky residue on the skin and is soluble in silicones, hydrocarbons, isoparaffin without soluble in water.
Isododecane can dissolve in silicones, hydrocarbons, isoparrafins.
Isododecane is a petroleum derived emollient of 12 carbons in length.


Isododecane is chemically similar to our naturally derived Undecane (C11) and Tridecane (C13) but rather than being a straight chained molecule, it is branched giving it slightly different spreading, solvating and evaporating qualities.
Isododecane belongs to a family of chemicals called Isoparaffins.
Isododecane enhances the spreadability of products and has a weightless feel on skin.



USES and APPLICATIONS of ISODODECANE:
Isododecane, mixture of isomer acts as a reaction medium used for polymerization reactions.
Isododecane is also useful as an emollient and solvent in skin care products due to its high spreadability, low viscosity and density.
Isododecane is commonly used in anti-aging serums and also useful in many different cosmetic items like eyeliner, hair care, hair sprays, perfume, conditioners and lotions.


Isododecane is synthetic hydrocarbon ingredient used as a solvent. Isododecane enhances the spreadability of products and has a weightless feel on skin.
All hydrocarbons used in cosmetics help prevent the evaporation of water from skin.
Among its many uses in beauty products, Isododecane’s not uncommon to see isododecane in long-wear lipsticks and foundations, where it helps minimize color transfer and lends itself to a lightweight, matte finish.


Isododecane is widely used in the cosmetic industry as a solvent for its emollient properties and because it evaporates quickly without leaving residues in the product.
For these features Isododecane is used to prepare the mixtures that, once dried, generate the end product (face powders, eye shadows, etc…)


Isododecane is recovered in liquid form and will be reused in the production process with the same purity as the virgin product.
The emitted stack air can be recirculated in the de siccator, by employing a close loop which brings considerable benefits in economic terms (saving on solvent purchase) and in environmental impact (in full compliance with regulations).


Isododecane has a long list of benefits in the cosmetic world.
This is the reason why Isododecane is present in every other cosmetic, skin care, and hair care product.
From being extremely lightweight to having a dry-touch finish, Isododecane is truly a magical ingredient.


Its popularity rises from the multiple benefits that Isododecane offers for the skin and hair.
Apart from trapping moisture, Isododecane helps in keeping the formulations soft and aids in easy gliding of the products.
Further, Isododecane results in a matte finish and gives a weightless feel to the skin and hair.


Isododecane is both a solvent and an emollient which, in short, means that it helps keep your skin hydrated and disperses other appearance-enhancing ingredients across the skin.
Isododecane is used as a solvent in the cosmetic industry since it carries silicones and pigments for makeup super well.


Isododecane’s used as an emollient for trapping moisture on the skin’s surface.
And since Isododecane goes on your skin, you should probably know more about isododecane besides what it does for aesthetics.
Chemically speaking, Isododecane is a colorless liquid hydrocarbon.


Isododecane is used in many common beauty, skin, and body care items to enhance the feel of them.
Isododecane also distributes hues and skin-plumping silicones to your face.
You’ll likely find Isododecane in a majority of your beauty products, including but not limited to moisturizer, creams, concealer, foundation, mascara, eyeliner, eyeshadow, lip gloss, lipstick, and more.


Isododecane is a clear, colorless and odorless, highly volatile (meaning it does not absorb into the skin but evaporates from it) liquid that's used as an emollient.
Isododecane gives a nice non-oily light skin feel and it can improve the slip of the formula without leaving a tacky residue behind.


Isododecane's also popular in make-up products as its volatility makes mascaras and foundations last longer.
If that would not be enough, Isododecane's also an excellent solvent, and it's a regular not only on the ingredients lists of make-ups but also on makeup removers.


Isododecane is used as a solvent.
Isododecane has a weightless feel on skin and enhances spreadability of products due to its low viscosity and density.
Isododecane helps prevent evaporation of water from the skin.


Isododecane is excellent emollient that can be used as replacement to oils in emulsions.
Isododecane is compatible with silicones for imparting shine, slip, and combability for hair care products.
Isododecane is used Conditions hair & skin.


In combination with Isohexadecane or Isoeicosane (which have similar molecular structures), it enables a wide range of skin feel, playtime, and plasticity depending on concentrations and desired results.
Thanks to high stability, Isododecane is used as an emollient and solid (UV-filter) carrying agent in many sun care applications.


Isododecane is a good ingredient for decorative cosmetics including, mascaras, lipsticks, and eyeliners incorporated as a soft emollient, pigment-carrying agent, or plasticizer.
Isododecane is miscible with silicones, other hydrocarbons, mineral oils, and alcohols.


In addition, Isododecane can be used as a co-solubilizer or co-emulsifier for many non-hydrocarbon materials.
Isododecane can be used as a replacement for oils in emulsions.
Isododecane is highly volatile and is usually used in non-residual products.


Isododecane is used in mascara, eyeliner, creams, lotions, hair care, conditioners, setting lotions, and hairspray.
Isododecane is typically used at 2-15%
Isododecane is a petroleum derived emollient of 12 carbons in length.


Isododecane is a key ingredient in the cosmetics market.
Isododecane is used for its emollient properties in a large number of skin care and hair treatment products.
Isododecane is also a major ingredient in long-lasting makeup products, such as waterproof mascaras or long-lasting liquid lipsticks.


Isododecane is used Mascara, eyeliner, creams, lotions, hair care, conditioners, hairsprays, perfumes.
Isododecane is used in lotion, cream, cosmetics, sunscreen, hair care, skin care products, etc.
Isododecane is an ultra-lightweight, volatile emollient useful for creating light, elegant emulsions for all types of skincare, haircare and personal care products.


Isododecane's also used as an ingredient in a variety of cosmetic products such as lipstick, mascara, eye shadow and hair gels.
Isododecane's used as an ingredient in a variety of cosmetic products such as lipstick, mascara, eye shadow and hair gels.
Isododecane can very quickly evaporate from the skin and does not leave a sticky residue.


Isododecane is soluble in silicones, hydrocarbons, iso-paraffin but completely insoluble in water.
Isododecane is suitable for use in place of oil in oil-free formulas that require extra lightness.
Use level ranges of Isododecane from 1% to 100% depending on the application.


Isododecane is used for external use only.
Isododecane is suitable for use in place of oil in oil-free formulas that require extra lightness. and prevents a sticky feeling on the skin including protection against water (water-repellent) such as Vitamin C Anhydrous, Mascara, various makeup products.


Isododecane is used as a solvent (solvent) or as a conductor (carrier) or disperser (disperser / spreader).
Among its many uses in beauty products, it’s not uncommon to see Isododecane in long-wear lipsticks and foundations, where it helps minimize color transfer and lends itself to a lightweight, matte finish.


Isododecane is a hydrocarbon that is widely used as an emollient and solvent.
Isododecane is not soluble in water but can dissolve in sillicones.
Isododecane is used Personal care, Hair care and cosmetics.


Isododecane can be used it in concentrations up to 15% and should be added to the oil phase of a mixture
Isododecane is a key ingredient in the cosmetics market.
Isododecane is used for its emollient properties in a large number of skin care and hair treatment products.


Isododecane is also a major ingredient in long-lasting makeup products, such as waterproof mascaras or long-lasting liquid lipsticks.
Isododecane provides the long-lasting performance, no transfer and waterproof effects, while maintaining optimal comfort.
According to Global Bioenergies, Isododecane can represent up to 50% of the formulations belonging to these categories.


Isododecane is used in a wide variety of beauty products like lipstick, foundation, mascara, eyeliner, skin serums, moisturizers, shampoo, conditioners, and more.
Isododecane is a solvent, as well as an emollient.
Isododecane helps retain moisture.


Isododecane breaks down easily for smooth application.
Isododecane spreads easily on the skin without leaving a thick or greasy residue.
Isododecane helps create a “matte” finish for lipstick, cheek color, and foundation.
Isododecane minimizes the transfer of color (e.g., lipstick marks on cups and silverware) helps provide a “weightless” feel.


-Conditions hair & skin:
Isododecane can be added to formulas as is, add to oil phase, use level 2-15%.
Isododecane is used for external use only.


-Skin care:
Isododecane protects and hydrates the skin, leaving it smooth and supple.
When added to skincare products, Isododecane also forms a barrier on the skin preventing moisture loss.
Further, Isododecane is lightweight and does not leave the skin feeling greasy or oily


-Hair care:
Isododecane moisturizes and repairs dry and damaged hair - without making them feel heavy or greasy.
Isododecane locks moisture on the scalp and contributes to the cream-like texture of hair care products.
This also helps in easy and even application


-Cosmetic Uses:
*perfuming agents
*skin conditioning - emollient
*solvents


-Cosmetic products:
Isododecane enhances the texture of the formulation and increases the spreadability of the product.
Isododecane is a non-comedogenic ingredient and does not block the pores or cause acne.
The matte finish that Isododecane provides is much loved



FUNCTIONS OF ISODODECANE:
*Emollient
*Solubilizer
*Carrier



WHAT DOES ISODODECANE DO IN A FORMULATION?
*Emollient
*Moisturising



WHAT ARE THE BENEFITS OF ISODODECANE?
Isododecane is a solvent, as well as an emollient.
In layman’s terms, this means that the ingredient:
*helps retain moisture
*breaks down easily for smooth application
*spreads easily on the skin without leaving a thick or greasy residue
*helps create a “matte” finish for lipstick, cheek color, and foundation
*minimizes the transfer of color (e.g., lipstick marks on cups and silverware)
*helps provide a “weightless” feel



WHAT ARE THE BENEFITS OF ISODODECANE?
*Creates a more even tone:
On the surface, your makeup will look visibly more even-toned and luminous when it contains Isododecane.

*Strengthens the skin's barrier:
Below the epidermis, you’ll feel that Isododecane creates a stronger skin barrier, stopping moisture from escaping and reducing dryness or flakiness overall, she explains.

*Helps retain moisture:
Isododecane helps the skin retain moisture, so it's excellent for dryer types.

*Doesn't leave a residue:
Isododecane is formulated to glide on easily and glide off just as easily (so it won't leave behind a sticky film or residue).

*Creates a silky-smooth texture:
Isododecane also plays a role in the way your makeup and skincare feel.
Isododecane imparts a silky smooth feel to products while giving a dry touch finish.
So the cream-like, supersoft texture of your moisturizer, concealer, foundation, etc.?
That often comes from Isododecane.

*Fast absorbing:
Unlike some skincare products, Isododecane quickly absorbs into the skin, meaning you lose less product.

*Non-irritating:
For the most part, Isododecane is non-irritating and safe for use on all skin types.

*Multiple forms of use:
As Isododecane is used in a wide range of topical products, there are plenty of options for how and when you can use it.



BENEFITS OF ISODODECANE:
*Has a weightless feel on skin and enhances spreadability of products due to its low viscosity and density
*Helps prevent evaporation of water from the skin
*Excellent emollient that can be used as replacement to oils in emulsions
*Compatible with silicones for imparting shine, slip, and combability for hair care products



USE AND BENEFITS OF ISODODECANE:
Isododecane is very well known for its practically weightless feel on the skin and excellent spreadability because of low viscosity and density.
Isododecane forms a film over the skin and hardly gets absorbed into the skin but, it also prevents the water loss from the skin.
While acting as a solvent, it also provides moisturization to skin.

Isododecane conditions the skin and hair.
Isododecane can be used as a replacement to oils in products especially emulsions.
Isododecane is also non-comedogenic.

Isododecane doesn’t provide any sensitivity or eruption for acne-prone skin.
Isododecane is similar to silicones in providing the slip and shine to hair.
Last but not least, Isododecane is used in perfumery as a solvent as well.
Isododecane is used in creams, lotions, decorative makeups, shampoos, and conditioners, etc.



FUNCTION OF ISODODECANE:
*Emollient
*conditioning
*moisturizing,
*shining
*enhance spreadability
*light feel.



WHAT TYPES OF PRODUCTS IS ISODODECANE USED IN?
Due to its chemical makeup, Isododecane is used in a wide variety of beauty products.
These include personal care items, such as moisturizers, as well as makeup and hair care products.

You may find the ingredient in the following:
*lipstick (especially long-wear formulas)
*foundation
*mascara
*eyeliner
*skin serums
*moisturizers
*shampoo
*conditioners
*hair serums
*hairspray



PROPERTIES OF ISODODECANE:
Isododecane is used as a waterproofing agent. Has a weightless feel on skin, enhances spreadability of products, helps prevent evaporation of water from the skin, excellent emollient and can be used as replacement to oils in emulsions.
Isododecane is compatible with silicones for imparting shine, slip, comb-ability for hair care products, conditions hair & skin.



SAFETY PROFILE OF ISODODECANE:
Isododecane is considered safe to be used on skin and hair in low concentrations.
However, Isododecane may show some minor side effects on highly sensitive skin.
Therefore, a patch test is recommended prior to full application.
Additionally, Isododecane is also vegan and halal.



FUNCTIONS OF ISODODECANE:
*Emollient:
Isododecane softens and softens the skin
*Solvent: D
Isododecane dissolves other substances
*Fragrant agent:
Isododecane is used for perfume and aromatic raw materials



FORMULATING BENEFITS OF ISODODECANE:
*Volatile solvent so great for dry-touch or quick-dry formulations including formulations that work by forming a film (long wear lipsticks, sunscreens, mascara).
*Light Feel
*Non-Greasy
*Excellent Solvency so great for oil cleansers, pigment wetting, active delivery etc.



ALTERNATIVES OF ISODODECANE:
*CYCLOMETHICONE



TYPE OF ISODODECANE:
*Emollient
*Solvent.



COMPARISON OF 3 TYPES OF HYDROCARBONS EMOLLIENT:
1. Isododecane lightest weight can volatilize.
Isododecane helps to blend the formula well.
2. Isohexadecane has more weight.
Isododecane little unable to evaporate Helps to blend well.
3. Isoeicosane have more weight.
A small amount of Isohexadecane is not volatile.
Helps to blend well



MAIN BENEFITS OF ISODODECANE:
Isododecane acts as a moisture-locking barrier for the skin, keeping it hydrated and smooth.
In addition to this (and while not a skincare benefit), Isododecane contributes to the cream-like or soft texture of many formulas so that they can easily (and evenly) glide silicones and pigments onto the skin.



WHO SHOULD USE ISODODECANE:
Anyone experiencing dryness or anyone who uses makeup, as long as they’re not allergic.
Isododecane is great for people with very dry and dull skin, especially those who have impaired barriers from eczema, seborrhea, psoriasis, and rosacea.



WHEN YOU CAN USE ISODODECANE:
Isododecane can be applied twice a day topically, in the morning and at night during your skincare routine.



ISODODECANE WORKS WELL WITH:
Virtually any other beauty product, as long as you’re storing Isododecane properly in a cool, dry area.
Isododecane is non-comedogenic and has a matte feel, so it is also great for patients that have oily skin and are acne-prone.
Essentially, anyone can use Isododecane.



DERIVED FROM AGRICULTURAL RESOURCES:
For producing this renewable Isododecane, Global Bioenergies relied on their proprietary innovative technology for converting plant resources (sugar and starch residues, agricultural and forestry waste), into isobutene, one of the main petroleum derivatives.
Then, after several steps respecting the naturalness criteria specific to the cosmetics market, isobutene was converted into Isododecane.



HEAT TOLERANCE OF ISODODECANE:
Isododecane can be used in hot process formulations.



FORMULATING IDEAS OF ISODODECANE:
Colour cosmetics including; mascara and lipstick, quick dry skincare, hair oils, cleansing oils, oil serums with light touch.



FORMULATION BENEFITS OF ISODODECANE:
*Volatile solvent - great for dry-touch or quick-dry formulations including formulations that work by forming a film (long wear lipsticks, sunscreens, mascara).
*Light Feel.
*Non-Greasy.
*Excellent Solvency so great for oil cleansers, pigment wetting, active delivery etc.



PHYSICAL and CHEMICAL PROPERTIES of ISODODECANE:
Boiling Point: 208.9°C
Melting Point: -50°C
Solubility: Insoluble in water
Viscosity: 1 cP
Physical state: liquid
Color: colorless
Odor: No data available
Melting point/freezing point: No data available
Initial boiling point and boiling range: 180 °C at 1013 hPa
Flammability (solid, gas): No data available
Upper/lower flammability or explosive limits:
Upper explosion limit: 3,8 %(V)
Lower explosion limit: 0,5 %(V)
Flash point: 37 °C - closed cup
Autoignition temperature: No data available
Decomposition temperature: No data available
pH: No data available
Viscosity
Viscosity, kinematic: No data available
Viscosity, dynamic: No data available
Water solubility: insoluble
Partition coefficient:
n-octanol/water:
log Pow: 6,338
Vapor pressure: 56,333 hPa at 65 °C
Density: 0,745 g/cm3
Relative density: No data available
Relative vapor density: No data available
Particle characteristics: No data available
Explosive properties: No data available
Oxidizing properties: No data available
Other safety information: No data available

Molecular Weight: 170.33 g/mol
XLogP3-AA: 6.4
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 0
Rotatable Bond Count: 8
Exact Mass: 170.203450829 g/mol
Monoisotopic Mass: 170.203450829 g/mol
Topological Polar Surface Area: 0Ų
Heavy Atom Count: 12
Formal Charge: 0
Complexity: 74.1
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes
Molecular Weight: 170.34
Boiling Point℃: 177
Density at 15℃ g/cm3: 0.750
Molten Viscosity: mm2・s-1 1.35
Latent Heat of Evaporation J/g: 272
Specific Heat at 20℃ J/ｇ・℃: 2.1935
Flash Point (close cup) ℃: 48
Explosive Limits in Air vol％: 1.0～6.0

Appearance: colorless to pale yellow clear liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 208.00 to 209.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.301000 mmHg @ 25.00 °C. (est)
Flash Point: 141.00 °F. TCC ( 60.80 °C. ) (est)
logP (o/w): 6.665 (est)
Soluble in: water, 0.09742 mg/L @ 25 °C (est)
InChI: InChI=1S/C12H26/c1-4-5-6-7-8-9-10-11-12(2)3/h12H,4-11H2,1-3H3
InChIKey: GTJOHISYCKPIMT-UHFFFAOYSA-N
Boiling Point: 177.1 ℃ at 760 mmHg
Melting Point: <= -50°C
Flash Point: 58.4°C
Density: 0.75 g/cm3
Solubility: water, 0.09742 mg/L @ 25 °C (est)
Appearance: Light yellow clear liquid
Assay: 0.99
EINECS: 250-816-8
Log P: 4.78310
Refractive Index: 1.421



FIRST AID MEASURES of ISODODECANE:
-Description of first-aid measures:
*General advice:
Consult a physician.
Show this material safety data sheet to the doctor in attendance.
*If inhaled:
If breathed in, move person into fresh air.
Consult a physician.
*In case of skin contact:
Wash off with soap and plenty of water.
Consult a physician.
*In case of eye contact:
Flush eyes with water as a precaution.
*If swallowed
Do NOT induce vomiting.
Rinse mouth with water.
Consult a physician.
-Indication of any immediate medical attention and special treatment needed:
No data available



ACCIDENTAL RELEASE MEASURES of ISODODECANE:
-Environmental precautions:
Prevent further leakage or spillage if safe to do so.
Do not let product enter drains.
Discharge into the environment must be avoided.
-Methods and materials for containment and cleaning up:
Contain spillage, and then collect with non-combustible absorbent material.



FIRE FIGHTING MEASURES of ISODODECANE:
-Extinguishing media:
*Suitable extinguishing media:
Dry powder
Dry sand
*Unsuitable extinguishing media:
Do NOT use water jet.
-Further information:
Use water spray to cool unopened containers.



EXPOSURE CONTROLS/PERSONAL PROTECTION of ISODODECANE:
-Control parameters:
--Ingredients with workplace control parameters:
-Exposure controls:
--Personal protective equipment:
*Eye/face protection:
Face shield and safety glasses
*Skin protection:
Handle with gloves.
Wash and dry hands.
Full contact:
Material: Nitrile rubber
Minimum layer thickness: 0,4 mm
Break through time: 480 min
Splash contact:
Material: Nitrile rubber
Minimum layer thickness: 0,11 mm
Break through time: 30 min
*Body Protection:
Complete suit protecting against chemicals
-Control of environmental exposure:
Prevent further leakage or spillage if safe to do so.
Do not let product enter drains.
Discharge into the environment must be avoided.



HANDLING and STORAGE of ISODODECANE:
-Precautions for safe handling:
*Advice on safe handling:
No smoking.
Take measures to prevent the build up of electrostatic charge.
*Hygiene measures:
Handle in accordance with good industrial hygiene and safety practice.
Wash hands before breaks and at the end of workday.
-Conditions for safe storage, including any incompatibilities:
*Storage conditions:
Keep container tightly closed in a dry and well-ventilated place.
Containers which are opened must be carefully resealed and kept upright to prevent leakage.
Store in cool place.



STABILITY and REACTIVITY of ISODODECANE:
-Reactivity:
No data available
-Chemical stability:
Stable under recommended storage conditions.
-Possibility of hazardous reactions:
No data available
-Incompatible materials:
No data available



SYNONYMS:
2-methylundecane
2,2,4,6,6-Pentamethylheptane
2-Methylundecane
ISODODECANE
7045-71-8
Undecane, 2-methyl-
31807-55-3
2-Methylhendecane
UNII-H40FL8477B
H40FL8477B
EINECS 230-323-4
EINECS 250-816-8
2 2 4 6 6-PENTAMETHYLHEPTANE
isododecano
isodo-decane
DTXSID50873241
MFCD00036106
AKOS015912736
FT-0715064
M0239
Q2813826

Isododecane is a colorless liquid that is commonly found in many cosmetic, hair care, and skin care products.
The chemical formula of Isododecane is C12H26.


CAS Number: 31807-55-3 / 93685-81-5 / 13475-82-6
EC Number: 250-816-8 / 297-629-8 / 236-757-0
Chem/IUPAC Name: 2,2,4,6,6-Pentamethylheptane
Molecular Formula : C12H26



SYNONYMS:
2-methylundecane, 2,2,4,6,6-Pentamethylheptane, ISODODECANE, Undecane, 2-methyl-, 2-Methylhendecane, UNII-H40FL8477B, EINECS 230-323-4, EINECS 250-816-8, isododecano, isodo-decane, DTXSID50873241, MFCD00036106, AKOS015912736, FT-0715064, M0239, Q2813826, Isododecan,2,2,6,6-Tetramethyl-4-Methylenheptan



Isododecane is a branched chain aliphatic hydrocarbon with 12 carbons.
Isododecane is a clear, colorless, viscous,synthetic liquid.
Isododecane is a clear, colorless and odorless, highly volatile (meaning it does not absorb into the skin but evaporates from it) liquid that's used as an emollient.


Isododecane is a synthetic aliphatic hydrocarbon with a branched structure.
Isododecane is a safe, non-irritating, and non-comedogenic cosmetic-grade solvent and emollient with low viscosity, good volatility, spreadability, and drying time.


Isododecane is a relatively inert, colorless, odorless ingredient suitable for almost all types of skin, hair, sun, and lip care preparations.
Isododecane's also free from dyes and preservatives.
Isododecane is an important raw material for various industries.


In the cosmetics and personal care industry Isododecane has several critical functions.
Isododecane is a clear, colorless, volatile, and odorless liquid.
Isododecane provides a light, non-oily feel with little residue and excellent solvency.


Isododecane is a branched hydrocarbon from the substance group of alkanes with the molecular formula C12H26.
Isododecane is a mixture of different isomers of dodecane, with the main isomer being 2,2,4,6,6-pentamethylheptane, which accounts for more than 80%.
Whilst isododecane is insoluble in water, Isododecane is very soluble/miscible with many organic solvents such as alcohols, ethers, esters and natural formulation components.


Isododecane is both a solvent and an emollient which, in short, means that it helps keep your skin hydrated and disperses other appearance-enhancing ingredients across the skin.
Chemically speaking, Isododecane is a colorless liquid hydrocarbon.


Isododecane is a hydrocarbon that is widely used as an emollient and solvent.
Isododecane is not soluble in water but can dissolve in sillicones.
Isododecane is a petroleum derived emollient of 12 carbons in length.


Isododecane is chemically similar to our naturally derived Undecane (C11) and Tridecane (C13) but rather than being a straight chained molecule, it is branched giving it slightly different spreading, solvating and evaporating qualities.
Isododecane belongs to a family of chemicals called Isoparaffins.


Isododecane is an oil-free hydrocarbon used as an emollient and solvent in skin care products.
Due to low viscosity and density, Isododecane imparts a weightless feel on skin and enhances spreadability of products.
Isododecane helps to prevent evaporation of water from the skin.


Isododecane is GMO- & preservative-free and vegan certified.
The shelf life of Isododecane is 24 months.
Hydrocarbon that is most often used as an emollient and solvent in skin care products.


Thanks to its low viscosity and density, Isododecane has a high spreadability.
Isododecane is colorless liquid.
Isododecane is water-insoluble, but completely soluble with silicones such as trimethylsiloxsilicate and dimethicone.


Isododecane is a clear and odorless liquid hydrocarbon that serves as a versatile ingredient in various cosmetic and personal care formulations.
Hydrocarbon is most often used as an emollient and solvent in skin care products.
Isododecane is an extremely lightweight, very volatile (fast evaporating) liquid.


Isododecane is an emollient and solvent that is frequently used in cosmetics.
Isododecane gives a fantastic dry-touch finish very quickly.
Isododecane is water-like clear liquid.


Isododecane is an ultra-lightweight Emollient.
Isododecane can quickly evaporate from the skin.
Isododecane does not clog pores.


Makes Isododecane not leave a sticky residue on the skin and is soluble in silicones, hydrocarbons, isoparaffin without soluble in water.
Isododecane is suitable for use in place of oil in oil-free formulas that require extra lightness and prevents a sticky feeling on the skin including protection against water (water-repellent) such as Vitamin C Anhydrous, Mascara, various makeup products


Isododecane is a useful aliphatic medium for polymerization reactions.
Isododecane is a versatile and multifunctional ingredient widely used in the cosmetic and personal care industry for its unique properties and wide range of applications.


In summary, a great cosmetic grade Isododecane is a versatile and indispensable ingredient in the cosmetic and personal care industry, prized for its lightweight texture, excellent spreadability, and long-lasting properties.
Whether used as a solvent, carrier, or film-forming agent, Isododecane enhances the performance and sensory experience of skincare, haircare, and makeup products, allowing consumers to achieve their desired look and feel with ease and confidence.


Isododecane is a fragrance, emollient, and solvent.
As an emollient, Isododecane helps your skin stay soft and hydrated.
Emollients help trap moisture into your skin.


Isododecane's role as a solvent makes it a great texture enhancer.
Isododecane spreads smoothly on skin and does not leave a sticky feeling behind.
Isododecane also helps prevent color transfer in makeup products.


Isododecane is not absorbed into skin.
Isododecane is a petroleum derived emollient of 12 carbons in length.
Isododecane is a key ingredient in the cosmetics market.


Isododecane is an ultra-lightweight, volatile emollient useful for creating light, elegant emulsions for all types of skincare, haircare and personal care products.
Isododecane can very quickly evaporate from the skin and does not leave a sticky residue.


Isododecane is soluble in silicones, hydrocarbons, iso-paraffin but completely insoluble in water.
Isododecane is a key ingredient in the cosmetics market.
While the long-lasting make-up segment already weights around 25% of the global makeup market, Isododecane was only sourced from petrochemicals.



USES and APPLICATIONS of ISODODECANE:
Isododecane is used as a solvent.
Isododecane is a hydrocarbon that is most often used as an emollient and solvent in skin care products.
Isododecane has a weightless feel on skin and enhances spreadability of products due to its low viscosity and density.


Isododecane helps prevent evaporation of water from the skin.
Isododecane is excellent emollient that can be used as replacement to oils in emulsions.
Isododecane is compatible with silicones for imparting shine, slip, and combability for hair care products.


Isododecane is conditions hair & skin.
Isododecane is a common ingredient found in many different types of beauty products.
This colorless liquid, Isododecane, is often added to cosmetics and other personal care products to keep them soft and to help them glide easily on the skin.


Its popularity rises from the multiple benefits that Isododecane offers for the skin and hair.
Apart from trapping moisture, Isododecane helps in keeping the formulations soft and aids in easy gliding of the products.
Further, Isododecane results in a matte finish and gives a weightless feel to the skin and hair.


Thanks to good solubilizing properties, Isododecane is suitable for cleansing applications which eliminate oil, dirt, and impurities from the skin's surface and effectively remove decorative cosmetics.
Isododecane is compatible and completely soluble with silicones, hydrocarbons, isoparaffin, and mineral spirits.


Isododecane is highly volatile and is usually used in non-residual products.
Isododecane has a low density and low viscosity.
Isododecane can be used as a replacement for oils in emulsions that leave a light non-greasy feeling.


In combination with Isohexadecane or Isoeicosane (which have similar molecular structures), Isododecane enables a wide range of skin feel, playtime, and plasticity depending on concentrations and desired results.
Thanks to high stability, Isododecane is used as an emollient and solid (UV-filter) carrying agent in many sun care applications.


Isododecane is a good ingredient for decorative cosmetics including, mascaras, lipsticks, and eyeliners incorporated as a soft emollient, pigment-carrying agent, or plasticizer.
Isododecane is miscible with silicones, other hydrocarbons, mineral oils, and alcohols.


In addition, Isododecane can be used as a co-solubilizer or co-emulsifier for many non-hydrocarbon materials.
Isododecane is used in mascara, eyeliner, creams, lotions, hair care, conditioners, setting lotions, and hairspray.
Isododecane is dermatologically safe and typically used at concentrations of 2-15%.


Isododecane gives a nice non-oily light skin feel and it can improve the slip of the formula without leaving a tacky residue behind.
Isododecane's also popular in make-up products as its volatility makes mascaras and foundations last longer.
If that would not be enough, Isododecane's also an excellent solvent, and it's a regular not only on the ingredients lists of make-ups but also on makeup removers.


Isododecane is used in all kinds of skin care, sunscreen, mascara, eyeliner, facial makeup, lip products and other products that need to improve spreadability without leaving a sense of residue.
Isododecane is used in makeup remover products, providing oil-free and refreshing skin feeling after makeup remover, a substitute for silicone in cosmetics, etc.


Isododecane's used as an ingredient in a variety of cosmetic products such as lipstick, mascara, eye shadow and hair gels.
With a viscosity of approximately 1 centipoise, Isododecane can be used in applications which include: hair care, sun care, antiperspirants, color cosmetics, mascaras and fragrance products.


In addition to its qualities such as excellent spreadability and smoothness on the skin, Isododecane is an important alternative to cyclosiloxanes (D4 and D5), the use of which have been strictly regulated by the EU since 2020.
Isododecane is used as a solvent in the cosmetic industry since it carries silicones and pigments for makeup super well.


And Isododecane’s used as an emollient for trapping in moisture on the skin’s surface.
And since Isododecane goes on your skin, you should probably know more about isododecane besides what it does for aesthetics.
Isododecane is used in many common beauty, skin, and body care items to enhance the feel of them, and it also distributes hues and skin-plumping silicones to your face.


You’ll likely find isododecane in a majority of your beauty products, including but not limited to moisturizer, creams, concealer, foundation, mascara, eyeliner, eyeshadow, lip gloss, lipstick, and more.
Isododecane is an excellent solvent and can be used in a variety of cosmetic and personal care ingredients.


Isododecane has a weightless feel and enhance spreadability of products.
Isododecane is used personal care, Hair care and cosmetics.
Isododecane can be used in concetrations up to 15% and should be added to the oil phase of a mixture.


Isododecane is used in all kinds of skin care, sunscreen, mascara, eyeliner, facial makeup, lip products and other products that need to improve spreadability without leaving a sense of residue.
Isododecane is used in makeup remover products, providing oil-free and refreshing skin feeling after makeup remover, a substitute for silicone in cosmetics, etc.


Isododecane can be used as an alternative to oils in emulsions.
Isododecane is compatible with silicones and offers shine, slip and combability for hair care products.
Isododecane also conditions hair and skin.


Isododecane is used in mascara, eyeliner, creams & lotions, conditioners, hairsprays and perfumes.
Synthetic hydrocarbon ingredient, Isododecane is used as a solvent.
Isododecane enhances the spreadability of products and has a weightless feel on skin.


All hydrocarbons used in cosmetics help prevent the evaporation of water from skin.
Among its many uses in beauty products, Isododecane’s not uncommon to see isododecane in long-wear lipsticks and foundations, where it helps minimize color transfer and lends itself to a lightweight, matte finish.


Application of Isododecane: Lotion, cream, cosmetics, sunscreen, hair care, skin care products, etc.
Isododecane is used as a waterproofing agent.
Isododecane has a weightless feel on skin, enhances spreadability of products, helps prevent evaporation of water from the skin, excellent emollient and can be used as replacement to oils in emulsions.


Isododecane is compatible with silicones for imparting shine, slip, comb-ability for hair care products, conditions hair & skin.
Isododecane can be added to formulas as is, add to oil phase, use level 2-15%.
Isododecane is used for external use only.


Applications of Isododecane: Mascara, eyeliner, stay-on melted lipstick/lipgloss ,creams, lotions, hair care, conditioners, hairsprays, perfumes.
Isododecane is commonly used as a solvent, emollient, and carrier agent in products like skincare, makeup, and hair care items.
Isododecane's also used as an ingredient in a variety of cosmetic products such as lipstick, mascara, eye shadow and hair gels.


Isododecane is suitable for use in place of oil in oil-free formulas that require extra lightness.
Isododecane is used for its emollient properties in a large number of skin care and hair treatment products.
Isododecane is also a major ingredient in long-lasting makeup products, such as waterproof mascaras or long-lasting liquid lipsticks.


Isododecane provides the long-lasting performance, no transfer and waterproof effects, while maintaining optimal comfort.
Isododecane is used for external use only.
Isododecane is used mascara, eyeliner, creams, lotions, hair care, conditioners, hairsprays, perfumes.


As a clear, colorless, and odorless liquid hydrocarbon, Isododecane offers a multitude of benefits for formulators and consumers alike, making it a popular choice in various skincare, haircare, and makeup products.
One of the key characteristics of Isododecane is its lightweight and non-greasy texture, which makes it an excellent solvent and carrier for active ingredients in cosmetic formulations.


Its low viscosity allows Isododecane to spread easily on the skin or hair, providing a smooth and silky feel without leaving behind any oily residue.
This makes Isododecane particularly well-suited for lightweight serums, moisturizers, and makeup products that require fast absorption and a matte finish.
Moreover, Isododecane is prized for its excellent spreadability and blending properties, which make it an ideal ingredient for formulating emulsions, creams, and lotions.


Isododecane's ability to evenly distribute pigments, oils, and other ingredients ensures a smooth and uniform application, resulting in a flawless finish and enhanced product performance.
Additionally, cosmetic grade Isododecane is valued for its long-lasting and water-resistant properties, which make it a popular choice in makeup products such as foundations, primers, and mascaras.


Isododecane's film-forming abilities create a protective barrier on the skin or lashes, helping to lock in moisture and enhance the longevity of makeup wear.
This makes cosmetic grade Isododecane especially beneficial for individuals with oily or combination skin who struggle with makeup fading or smudging throughout the day.


Furthermore, Isododecane is non-comedogenic and non-irritating, making it suitable for use in a wide range of skincare and haircare formulations, including products designed for sensitive or acne-prone skin.
Isododecane is used for its emollient properties in a large number of skin care and hair treatment products.


Isododecane is also a major ingredient in long-lasting makeup products, such as waterproof mascaras or long-lasting liquid lipsticks.Isododecane's gentle nature ensures compatibility with various skin types, while its lightweight texture makes it easy to incorporate into formulations without weighing them down or causing congestion.



WHAT TYPES OF PRODUCTS IS ISODODECANE USED IN?
Due to its chemical makeup, Isododecane is used in a wide variety of beauty products.
These include personal care items, such as moisturizers, as well as makeup and hair care products.

You may find Isododecane in the following:
*lipstick (especially long-wear formulas)
*foundation
*mascara
*eyeliner
*skin serums
*moisturizers
*shampoo
*conditioners
*hair serums
*hairspray



WHAT ARE THE BENEFITS OF ISODODECANE?
Isododecane is a solvent, as well as an emollient.
In layman’s terms, this means that Isododecane:
*helps retain moisture
*breaks down easily for smooth application
*spreads easily on the skin without leaving a thick or greasy residue
*helps create a “matte” finish for lipstick, cheek color, and foundation
*minimizes the transfer of color (e.g., lipstick marks on cups and silverware)
*helps provide a “weightless” feel



STORAGE OF ISODODECANE:
Stable when kept Isododecane in a closed container at a cool & dry place.



TEXTURE OF ISODODECANE:
Thin liquid with great slip, very fast evaporation, and great leftover skin feel.



CLAIMS OF ISODODECANE:
*Emollients > Hydrocarbons
*Solvents & Carriers
*preservative-free
*combing (wet)
*oil-free
*vegan
*light feeling
*spreading
*wet slip feel
*shine / radiance
*combing (dry)



FUNCTIONS OF ISODODECANE:
*Emollient :
Isododecane softens and smoothes the skin
*Solvent :
Isododecane dissolves other substances
*Perfuming :
Isododecane is used for perfume and aromatic raw materials



KEY FEATURES OF ISODODECANE:
– Solvent Properties:
Isododecane is a lightweight solvent that can dissolve a wide range of cosmetic ingredients, making it a useful component in makeup removers, cleansers, and other products.

– Quick Evaporation:
One of the notable characteristics of Isododecane is its rapid evaporation rate.
This property makes Isododecane ideal for formulas that need to dry quickly upon application.

– Lightweight Emollient:
Isododecane imparts a silky, non-greasy feel to products, which makes it an excellent emollient in various cosmetic products.
Isododecane can help create a smooth and luxurious texture.

– Long-Lasting Formulas:
Due to its ability to evaporate quickly, Isododecane can enhance the longevity of makeup products by helping them set in place and resist smudging or fading.

– Enhancing Skin Feel:
When included in skincare products, Isododecane can contribute to a velvety finish, leaving the skin feeling soft and smooth.

– Hair Care Benefits:
Isododecane is often used in hair serums and styling products for its lightweight texture and ability to add shine without weighing down the hair.

– Compatibility:
Isododecane is compatible with a wide range of cosmetic ingredients, allowing formulators to create versatile and effective formulations.

– Waterproof Formulas:
Its quick-drying and waterproof properties make Isododecane a preferred ingredient in many long-lasting and water-resistant products.

– Non-Comedogenic:
Isododecane is generally considered non-comedogenic, which means it is less likely to clog pores and is suitable for various skin types.

Isododecane’s versatile properties make it a popular choice in the cosmetic industry for creating a variety of products with enhanced texture, performance, and longevity.
Whether you’re formulating makeup, skincare, or hair care items, Isododecane can be a valuable addition to your creations.



FUNCTION OF ISODODECANE:
Emollient, conditioning, moisturizing, shining, enhance spreadability, light feel.



WHAT IS ISODODECANE USED FOR?
Isododecane has a long list of benefits in the cosmetic world.
This is the reason why Isododecane is present in every other cosmetic, skin care, and hair care product.
From being extremely lightweight to having a dry-touch finish, Isododecane is truly a magical ingredient.


*Skin care:
Isododecane protects and hydrates the skin, leaving it smooth and supple.
When added to skincare products, Isododecane also forms a barrier on the skin preventing moisture loss.
Further, Isododecane is lightweight and does not leave the skin feeling greasy or oily


*Hair care:
Isododecane moisturizes and repairs dry and damaged hair - without making them feel heavy or greasy.
Isododecane locks moisture on the scalp and contributes to the cream-like texture of hair care products.
Isododecane also helps in easy and even application


*Cosmetic products:
Isododecane enhances the texture of the formulation and increases the spreadability of the product.
Isododecane is a non-comedogenic ingredient and does not block the pores or cause acne.
The matte finish that Isododecane provides is much loved



ORIGIN OF ISODODECANE:
Isododecane is a branched chain of twelve carbons and twenty-six hydrocarbons.
Isododecane has long been made via petroleum resources but with increasing awareness, the industry is rapidly moving towards making plant-based and natural isododecane.
This is achieved by converting starch and sugar residues and forestry waste into isobutene.
This isobutene is then converted into Isododecane.



WHAT DOES ISODODECANE DO IN A FORMULATION?
*Emollient
*Moisturising



SAFETY PROFILE OF ISODODECANE:
Isododecane is considered safe to be used on skin and hair in low concentrations.
However, Isododecane may show some minor side effects on highly sensitive skin.
Therefore, a patch test is recommended prior to full application.
Additionally, Isododecane is also vegan and halal.



ALTERNATIVES OF ISODODECANE:
*CYCLOMETHICONE


TYPE OF INGREDIENT OF ISODODECANE:
Emollient and solvent.


MAIN BENEFITS OF ISODODECANE:
Isododecane acts as a moisture-locking barrier for the skin, keeping it hydrated and smooth.
In addition to this (and while not a skincare benefit), Isododecane contributes to the cream-like or soft texture of many formulas so that they can easily (and evenly) glide silicones and pigments onto the skin.


WHO SHOULD USE ISODODECANE:
Anyone experiencing dryness or anyone who uses makeup, as long as they’re not allergic.
Isododecane is great for people with very dry and dull skin, especially those who have impaired barriers from eczema, seborrhea, psoriasis, and rosacea.


WHEN YOU CAN USE ISODODECANE:
Isododecane can be applied twice a day topically, in the morning and at night during your skincare routine.


ISODODECANE WORKS WELL WITH:
Virtually any other beauty product, as long as you’re storing Isododecane properly in a cool, dry area.
Isododecane is non-comedogenic and has a matte feel, so it is also great for patients that have oily skin and are acne-prone.


DON’T USE WITH:
Those with super-sensitive skin types or a known allergy to the ingredient should not use Isododecane.



BENEFITS OF ISODODECANE:
*Isododecane has a weightless feel on skin and enhances spreadability of products due to its low viscosity and density
*Isododecane helps prevent evaporation of water from the skin
*Isododecane is excellent emollient that can be used as replacement to oils in emulsions
*Isododecane is compatible with silicones for imparting shine, slip, and combability for hair care products
*Isododecane is conditions hair & skin



ADVANTAGES OF ISODODECANE:
*100 % bio-based
*high purity, cosmetic quality
*odourless
*water clear, colourless



COSMETIC GRADE ISODODECANE:
Introducing our premium cosmetic grade Isododecane, meticulously crafted to meet the exacting standards of the cosmetic industry. Isododecane, with its CAS number 31807-55-3, stands as a hallmark of excellence in cosmetic formulations, offering unparalleled purity and performance.
Isododecane is presented as a colorless liquid, indicative of its high purity and quality.



FUNCTIONS OF ISODODECANE:
*Emollient
*Solubilizer
*Carrier
*Perfuming
*Solvent



FORMULATING BENEFITS OF ISODODECANE:
*Volatile solvent - great for dry-touch or quick-dry formulations including formulations that work by forming a film (long wear lipsticks, sunscreens, mascara).
*Light Feel.
*Non-Greasy.
*Excellent Solvency so great for oil cleansers, pigment wetting, active delivery etc.
*Use Levels: 1-100%.
*Heat Tolerance: Isododecane can be used in hot process formulations.
*Solubility: Oil.
*Formulating Ideas:
Colour cosmetics including; mascara and lipstick, quick dry skincare, hair oils, cleansing oils, oil serums with light touch.



WHY DO WE USE ISODODECANE IN FORMULATIONS?
Isododecane is incredibly useful in liquid cosmetics—I’d call it indispensable.
Isododecane is an excellent choice for liquifying cosmetics that we need to set quickly (liquid lipstick, liquid eyeliner, etc.) as it sets quickly but spreads beautifully before setting.
Isododecane is also an excellent solvent for strong film-forming silicone resins like trimethylsiloxysilicate.



DO YOU NEED ISODODECANE?
If you want to make liquid cosmetics Isododecane is necessary.



REFINED OR UNREFINED ?
Isododecane only exists as a refined product.



STRENGHTS OF ISODODECANE:
Fantastic fast-evaporating emollient.



WEAKNESSES OF ISODODECANE:
Not natural if that is a priority for you.
Low flash point (43°C/109°F).



ALTERNATIVES AND SUBSTITUTIONS OF ISODODECANE:
Nothing, really.
Cyclomethicone is also slippy and volatile, but doesn’t have the same dry-touch finish as isododecane and that finish can be absolutely instrumental to the performance of cosmetics like liquid lipsticks and eyeshadow primers.



HOW TO WORK WITH ISODODECANE:
Include Isododecane in the cool down phase of your recipes.
If necessary, very briefly heat it to incorporate Isododecane into pre-melted waxes.
Keep the flash point (43°C/109°F) in mind!
Don’t forget to replace the lid promptly—Isododecane will evaporate if left uncovered!



STORAGE AND SHELF LIFE OF ISODODECANE:
Stored somewhere cool, dark, and dry, Isododecane should last at least two years.



TIPS, TRICKS, AND QUIRKS OF ISODODECANE:
Its weightless feel and fast evaporation speed make Isododecane an excellent addition to many products where we want great spreadability but no residual weight—think cosmetics and hair products.
Isododecane is a great solvent, which makes it fantastic for cleaning up hard-to-clean messes!
I find Isododecane brilliant for cleaning up stubborn smudges of colourful cosmetics.



USAGE RATE OF ISODODECANE:
Isododecane can be added to formulas as is, add to oil phase, use level 2-15%.



FORMULATING BENEFITS OF ISODODECANE:
*Volatile solvent so great for dry-touch or quick-dry formulations including formulations that work by forming a film (long wear lipsticks, sunscreens, mascara).
*Light Feel
*Non-Greasy
*Excellent Solvency so great for oil cleansers, pigment wetting, active delivery etc.
*Use Levels: 1-100%



HEAT TOLERANCE OF ISODODECANE:
Isododecane can be used in hot process formulations but should be handled cautiously around heat.
The vapours are flammable and the oil has a closed cup flash point of 37C (70% ethanol has a flash point of 16.6C for comparrison).



FORMULATING IDEAS OF ISODODECANE:
Formulating Ideas:
Isododecane is colour cosmetics including mascara and lipstick, quick dry skincare, hair oils, cleansing oils, oil serums with light touch.



BENEFITS OF ISODODECANE:
*Isododecane gives good spreadability and helps to retain moisture on the skin.
*Isododecane is good conditioner for hair and skin



ISODODECANE IS DERIVED FROM AGRICULTURAL RESOURCES:
Thanks to this technological breakthrough, the entire long-lasting make-up segment might get rid from petroleum resources.
For producing this renewable Isododecane, Global Bioenergies relied on their proprietary innovative technology for converting plant resources (sugar and starch residues, agricultural and forestry waste), into isobutene, one of the main petroleum derivatives.
Then, after several steps respecting the naturalness criteria specific to the cosmetics market, isobutene was converted into Isododecane.



WHAT IS ISODODECANE?
Isoparaffins are branched chain hydrocarbons. Isoparaffin ingredients most frequently found cosmetics and personal care products are C13-14 Isoparaffin, Isododecane and Isohexadecane.

Other Isoparaffin ingredients that may be found in cosmetics and personal care products include: C7-8 Isoparaffin, C8-9 Isoparaffin, C9-11 Isoparaffin, C9-12 Isoparaffin, C9-13 Isoparaffin, C9-14 Isoparaffin, C9-16 Isoparaffin, C10-11 Isoparaffin, C10-12 Isoparaffin, C10-13 Isoparaffin, C11-12 Isoparaffin, C11-13 Isoparaffin, C11-14 Isoparaffin, C12-14 Isoparaffin, C12-20 Isoparaffin, C13-16 Isoparaffin, C18-70 Isoparaffin, C20-40 Isoparaffin, Isooctane andIsoeicosane.

In cosmetics and personal care products, Isoparaffin ingredients may be used in eye makeup preparations, including mascara, makeup preparations, manicuring preparations, skin care and hair care products.



WHY IS ISODODECANE USED?
The isoparaffin ingredients function primarily as solvents in cosmetics and personal care products.
The following additional functions have also been reported for the isoparaffin ingredients.
Skin-conditioning agent — emollient — Isohexadecane, C9-16 Isoparaffin, C12-20 Isoparaffin, C20-40 Isoparaffin, Isoeicosane

Skin-conditioning agent — miscellaneous — C11-12 Isoparaffin
Skin-conditioning agent — occlusive – C18-17 Isoparaffin
Viscosity decreasing agent — C7-8 Isoparaffin, C8-9 Isoparaffin, C9-11 Isoparaffin, C9-12 Isoparaffin, C9-13 Isoparaffin, C9-14 Isoparaffin, C10-11 Isoparaffin, C10-12 Isoparaffin, C11-14 Isoparaffin



PHYSICAL and CHEMICAL PROPERTIES of ISODODECANE:
Boiling Point: 208.9°C
Melting Point: -50°C
Solubility: Insoluble in water
Viscosity: 1 cP
Physical state: liquid
Color: colorless
Odor: No data available
Melting point/freezing point: No data available
Initial boiling point and boiling range: 180 °C at 1013 hPa
Flammability (solid, gas): No data available
Upper/lower flammability or explosive limits:
Upper explosion limit: 3,8 %(V)

Lower explosion limit: 0,5 %(V)
Flash point: 37 °C - closed cup
Autoignition temperature: No data available
Decomposition temperature: No data available
pH: No data available
Viscosity
Viscosity, kinematic: No data available
Viscosity, dynamic: No data available
Water solubility: insoluble
Partition coefficient:
n-octanol/water:
log Pow: 6,338

Vapor pressure: 56,333 hPa at 65 °C
Density: 0,745 g/cm3
Relative density: No data available
Relative vapor density: No data available
Particle characteristics: No data available
Explosive properties: No data available
Oxidizing properties: No data available
Other safety information: No data available
Molecular Weight: 170.33 g/mol
XLogP3-AA: 6.4
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 0
Rotatable Bond Count: 8
Exact Mass: 170.203450829 g/mol

Monoisotopic Mass: 170.203450829 g/mol
Topological Polar Surface Area: 0Ų
Heavy Atom Count: 12
Formal Charge: 0
Complexity: 74.1
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes
Molecular Weight: 170.34

Boiling Point℃: 177
Density at 15℃ g/cm3: 0.750
Molten Viscosity: mm2・s-1 1.35
Latent Heat of Evaporation J/g: 272
Specific Heat at 20℃ J/ｇ・℃: 2.1935
Flash Point (close cup) ℃: 48
Explosive Limits in Air vol％: 1.0～6.0
Appearance: colorless to pale yellow clear liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 208.00 to 209.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.301000 mmHg @ 25.00 °C. (est)
Flash Point: 141.00 °F. TCC ( 60.80 °C. ) (est)

logP (o/w): 6.665 (est)
Soluble in: water, 0.09742 mg/L @ 25 °C (est)
InChI: InChI=1S/C12H26/c1-4-5-6-7-8-9-10-11-12(2)3/h12H,4-11H2,1-3H3
InChIKey: GTJOHISYCKPIMT-UHFFFAOYSA-N
Boiling Point: 177.1 ℃ at 760 mmHg
Melting Point: <= -50°C
Flash Point: 58.4°C
Density: 0.75 g/cm3
Solubility: water, 0.09742 mg/L @ 25 °C (est)
Appearance: Light yellow clear liquid
Assay: 0.99
EINECS: 250-816-8
Log P: 4.78310
Refractive Index: 1.421
Appearance: Water-like clear liquid

Usage rate: Up to 20%
Texture: Thin liquid with great slip, very fast evaporation, and great leftover skin feel
Scent: Nothing noticeable
Absorbency Speed: Very fast evaporation
Solubility: Soluble with silicones, hydrocarbons, isoparaffin, and mineral spirits
Appearance: Liquid
Color value (APHA): ≤10
Density @ 20°C: 0.7469 g/cm3
Peroxides (Calculated as H2O2): ≤1.0 mg/kg
Density at 15°C: 0.7505 g/cm3
Bromine index: ≤15 mg/100
Sum of C12 hydrocarbons: ≥98%
Sum of C8 + C16 hydrocarbons: ≤2.0%

Boiling Point: 208.9°C
Melting Point: -50°C
Solubility: Insoluble in water
Viscosity: 1 cP
Grade: Cosmetic grade
Appearance: Clear liquid
Aromatics Content: 10 mg/kg
Bromine Index: 5 mgBr/100g
Sulfur Content: Below 1 ppm
Density at 15°C: 0.75 g/cm³
Color: 5 APHA
Flash Point: 51°C
Water Content: 42 ppm
Refractive Index at 20°C: 1.42



FIRST AID MEASURES of ISODODECANE:
-Description of first-aid measures:
*General advice:
Consult a physician.
Show this material safety data sheet to the doctor in attendance.
*If inhaled:
If breathed in, move person into fresh air.
Consult a physician.
*In case of skin contact:
Wash off with soap and plenty of water.
Consult a physician.
*In case of eye contact:
Flush eyes with water as a precaution.
*If swallowed
Do NOT induce vomiting.
Rinse mouth with water.
Consult a physician.
-Indication of any immediate medical attention and special treatment needed:
No data available



ACCIDENTAL RELEASE MEASURES of ISODODECANE:
-Environmental precautions:
Prevent further leakage or spillage if safe to do so.
Do not let product enter drains.
Discharge into the environment must be avoided.
-Methods and materials for containment and cleaning up:
Contain spillage, and then collect with non-combustible absorbent material.



FIRE FIGHTING MEASURES of ISODODECANE:
-Extinguishing media:
*Suitable extinguishing media:
Dry powder
Dry sand
*Unsuitable extinguishing media:
Do NOT use water jet.
-Further information:
Use water spray to cool unopened containers.



EXPOSURE CONTROLS/PERSONAL PROTECTION of ISODODECANE:
-Control parameters:
--Ingredients with workplace control parameters:
-Exposure controls:
--Personal protective equipment:
*Eye/face protection:
Face shield and safety glasses
*Skin protection:
Handle with gloves.
Wash and dry hands.
Full contact:
Material: Nitrile rubber
Minimum layer thickness: 0,4 mm
Break through time: 480 min
Splash contact:
Material: Nitrile rubber
Minimum layer thickness: 0,11 mm
Break through time: 30 min
*Body Protection:
Complete suit protecting against chemicals
-Control of environmental exposure:
Prevent further leakage or spillage if safe to do so.
Do not let product enter drains.
Discharge into the environment must be avoided.



HANDLING and STORAGE of ISODODECANE:
-Precautions for safe handling:
*Advice on safe handling:
No smoking.
Take measures to prevent the build up of electrostatic charge.
*Hygiene measures:
Handle in accordance with good industrial hygiene and safety practice.
Wash hands before breaks and at the end of workday.
-Conditions for safe storage, including any incompatibilities:
*Storage conditions:
Keep container tightly closed in a dry and well-ventilated place.
Containers which are opened must be carefully resealed and kept upright to prevent leakage.
Store in cool place.



STABILITY and REACTIVITY of ISODODECANE:
-Reactivity:
No data available
-Chemical stability:
Stable under recommended storage conditions.
-Possibility of hazardous reactions:
No data available
-Incompatible materials:
No data available

Isodragol is an ester oil providing skin care products with a luxurious skin feel.
Isodragol provides a perceivable cushion effect and a prolonged play time on the skin.
Isodragol is a viscous emollient with softening and caring effect.

CAS: 56554-53-1
MF: C30H56O6
MW: 512.76
EINECS: 260-257-1

Synonyms
propane-1,2,3-triyl 3,5,5-trimethylhexanoate;ISODRAGOL;Propan-1,2,3-triyl-3,5,5-trimethylhexanoat;Glyceryl triisononanoate;Tris(3,5,5-trimethylhexanoic acid)1,2,3-propanetriyl ester;Einecs 260-257-1;Hexanoic acid, 3,5,5-trimethyl-, 1,2,3-propanetriyl ester (9CI);iTriisononanoin;Isodragol;56554-53-1;XF4K22WN6T;206354-95-2;Isononanoic acid, 1,2,3-propanetriyl ester;2,3-bis(3,5,5-trimethylhexanoyloxy)propyl 3,5,5-trimethylhexanoate;Hexanoic acid, 3,5,5-trimethyl-, 1,2,3-propanetriyl ester;UNII-XF4K22WN6T;propane-1,2,3-triyl tris(3,5,5-trimethylhexanoate);DUB TING;glycerol triisononanoate;GLYCERYL TRIISONONANOATE;ISODRAGOL 660061;SCHEMBL21439838;DTXSID10971994;EINECS 260-257-1;1,3-bis(3,5,5-trimethylhexanoyloxy)propan-2-yl 3,5,5-trimethylhexanoate;DB-238149;NS00007671;EC 260-257-1;Q27293817;Isononanoic acid, 1,1',1''-(1,2,3-propanetriyl) ester;2,3-Bis[(3,5,5-trimethylhexanoyl)oxy]propyl 3,5,5-trimethylhexanoate #

Due to its viscosity, Isodragol comes with a perceivable cushion effect and prolonged playtime on the skin.
A low surface tension leads to outstanding wetting properties for pigments.
Isodragol gives a better pay-off (color deposition).
Isodragol is used in lipstick formulations.

ISONONANOIC ACID; 3,5,5-Trimethylhexansäure (German); ácido 3,5,5-trimetilhexanoico (Spanish); Acide 3,5,5-trimethylhexanoïque , cas no: 3302-10-1

Isononanoic acid is a natural product found in Solanum pennellii with data available.

Isononanoic acid is a branched-chain saturated fatty acid consisting of octanoic acid carrying a 7-methyl group.
Isononanoic acid is a branched-chain saturated fatty acid, a medium-chain fatty acid and a methyl-branched fatty acid.

CAS Number: 3302-10-1
EC Number: 221-975-0
Molecular Formula: C9H18O2
Molecular Weight: 158.2

Isononanoic acid (3,5,5-Trimethylhexanoic acid) is a critical carboxylic acid intermediate.
Isononanoic acid is used in the production of polyol ester based synthetic lubricants for refrigeration or aviation.

The high and consistent purity of Isononanoic acid provides precise and reliable attributes to the applications.
Isononanoic acid is also used as a corrosion inhibitor in industrial fluids and coolants.

Isononanoic acid is used as a monomer in the synthesis of alkyd resins for stoving enamels and two-component paints.
Isononanoic acid is a monofunctional carboxylic acid intermediate.

Isononanoic acid is a carboxylic acid with the chemical formula C9H18O2.
Isononanoic acid is a colorless liquid that dissolves in organic solvents such as ethanol, ether, and benzene.

Isononanoic acid is used in the production of various chemicals, including esters, plasticizers, and lubricants.
Isononanoic acid is also used as a raw material in the production of coatings, adhesives, and inks.
Isononanoic acid's similar with 3,5,5-trimethylhexanoic acid, but not totally the same in few applications.

Isononanoic Acid is a mixture of isomers with a 3,5,5-trimethyl hexanoic acid content of about 90%, and is obtained by oxidation of the corresponding isononyl aldehyde.
The clear, colorless liquid with a faint odor is miscible with the usual organic solvents.
Isononanoic Acid is only sparingly soluble in water.

Isononanoic acid esters are used as base stocks for synthetic lubricants and metalworking fluids, and as plasticizers.
Isononanoic acid salts are used as paint driers and as polyvinyl chloride stabilizers.
Isononanoic acid peroxides are used as polymerization catalysts.

Isononanoic acid, also called pelargonic acid, is an organic compound with structural formula CH3(CH2)7CO2H.
Isononanoic acid is a nine-carbon fatty acid.

Isononanoic acid is a colorless oily liquid with an unpleasant, rancid odor.
Isononanoic acid is nearly insoluble in water, but very soluble in organic solvents.
The esters and salts of Isononanoic acid are called nonanoates.

Isononanoic acid refractive index is 1.4322.
Isononanoic acid critical point is at 712 K (439 °C) and 2.35 MPa.

Isononanoic acid is registered under the REACH Regulation and is manufactured in and / or imported to the European Economic Area, for intermediate use only.
Isononanoic acid is used in formulation or re-packing.

Uses of Isononanoic acid:
Isononanoic acid is used in the production of polyol ester based synthetic lubricants for refrigeration or aviation.
Isononanoic acid is used as a monomer in the synthesis of alkyd resins for stoving enamels and two-component paints.
Isononanoic acid is also used as a corrosion inhibitor in industrial fluids and coolants.

Coatings:
Isononanoic acid is used as a monomer in the synthesis of alkyd resins for stoving enamels and two-component paints (primers and topcoats).
Isononanoic acid brings better yellowing performance in comparison to fatty acids.

Paint driers based on metal salts are also produced with Isononanoic acid.

Lubricants:
Isononanoic acid is used in the production of polyolester synthetic lubricants

Preparation and Occurrence of Isononanoic acid:
Isononanoic acid occurs naturally as esters in the oil of pelargonium.
Together with azelaic acid, Isononanoic acid is produced industrially by ozonolysis of oleic acid.

Synthetic esters of Isononanoic acid, such as methyl nonanoate, are used as flavorings.
Isononanoic acid is also used in the preparation of plasticizers and lacquers.

The derivative 4-nonanoylmorpholine is an ingredient in some pepper sprays.
The ammonium salt of Isononanoic acid, ammonium nonanoate, is an herbicide.
Isononanoic acid is commonly used in conjunction with glyphosate, a non-selective herbicide, for a quick burn-down effect in the control of weeds in turfgrass.

Pharmacological Effects of Isononanoic acid:
Isononanoic acid may be more potent than valproic acid in treating seizures.
Moreover, in contrast to valproic acid, nonanoic acid exhibited no effect on HDAC inhibition, suggesting that Isononanoic acid is unlikely to show HDAC inhibition-related teratogenicity.

Stability and Reactivity of Isononanoic acid:

Reactivity:
The reactivity of Isononanoic acid corresponds to the typical reactivity shown by Isononanoic acid group as describedinany text book on organic chemistry.

Chemical stability:
Stable under recommended storage conditions.

Possibility of hazardous reactions:
Hazardous polymerisation does not occur.

Conditions to avoid:
Avoid contact with heat, sparks, open flame and static discharge.
Avoid any source of ignition.

Incompatible materials:
Bases, amines.

Hazardous decomposition products
No decomposition if stored and applied as directed.

Handling and Storage of Isononanoic acid:

Advice on safe handling:
Avoid contact with skin, eyes and clothing.
Wash hands before breaks and immediately after handling Isononanoic acid.

Provide sufficient air exchange and/or exhaust in work rooms.

Hygiene measures:
When using, do not eat, drink or smoke.

Take off all contaminated clothing immediately.
Wash handsbeforebreaks and immediately after handling Isononanoic acid.

Conditions for safe storage, including any incompatibilities:

Advice on protection against fire and explosion:
Keep away from sources of ignition - No smoking.
Take necessary action to avoid static electricity discharge(which might cause ignition of organic vapours).

In case of fire, emergency cooling with water spray shouldbeavailable.
Ground and bond containers when transferring material.
Vapour/air-mixtures are explosiveat intensewarming.

Technical Measures/Storage Conditions:
Keep containers tightly closed in a cool, well-ventilated place.
Handle and open container with care.
Keepat temperatures between 0 and 38 °C (32 and 100 °F).

Suitable material:
Stainless steel

Unsuitable material:
Mild steel, copper, brass, including their alloys
Temperature class: T2

Specific end uses:
Intermediate
Formulation
Lubricants
Metal working fluids / rolling oils
Use in laboratories

First Aid Measures of Isononanoic acid:

Inhalation:
Keep at rest.
Aerate with fresh air.
When symptoms persist or in all cases of doubt seek medical advice.

Eyes:
Rinse immediately with plenty of water, also under the eyelids, for at least 15 minutes.
Remove contact lenses.
Immediate medical attention is required.

Skin:
Wash off immediately with soap and plenty of water.
When symptoms persist or in all cases of doubt seekmedicaladvice.

Ingestion:
Call a physician immediately.
Do not induce vomiting without medical advice.

Most important symptoms and effects, both acute and delayed:

Main symptoms:
Cough, headache, nausea, shortness of breath.

Special hazard:
Lung irritation, Lung oedema.

Indication of any immediate medical attention and special treatment needed:

General advice:
Remove contaminated, soaked clothing immediately and dispose of safely.
First aider needs to protect himself.

Treat symptomatically.
If ingested, flush stomach and compensate acidosis.

Firefighting Measures of Isononanoic acid:

Suitable extinguishing media:
Foam, dry chemical, carbon dioxide (CO2), water spray.

Unsuitable Extinguishing Media:
Do not use a solid water stream as Isononanoic acid may scatter and spread fire.

Special hazards arising from Isononanoic acid or mixture:

Under conditions giving incomplete combustion, hazardous gases produced may consist of:
Carbon monoxide (CO)
Carbon dioxide (CO2)
Combustion gases of organic materials must in principle be graded as inhalation poisons.
Vapour/air-mixtures are explosive at intense warming.
Vapours are heavier than air and may spread along floors.

Advice for firefighters:

Special protective equipment for firefighters:
Fire fighter protection should include a self-contained breathing apparatus (NIOSH-approved or EN133) andfull fire-fighting turn out gear.

Precautions for firefighting:
Cool containers / tanks with water spray.
Dike and collect water used to fight fire.
Keep people away fromandupwind of fire.

Identifiers of Isononanoic acid:
Chemical Name: 3,5,5-TRIMETHYLHEXANOIC ACID
Molecular Formula: C9H18O2
Molecular Weight: 158.2
CAS RN: 3302-10-1(3,5,5-Trimethylhexanoic Acid)
EINECS No.: 221-975-0(3,5,5-Trimethylhexanoic Acid)

Molecular Formula: C9H18O2
Average mass: 158.238 Da
Monoisotopic mass: 158.130676 Da
ChemSpider ID: 82141

CAS: 3302-10-1
EINECS: 221-975-0

Properties of Isononanoic acid:
Grade: Technical
Appearance: liquid
Auto Ignition Temperature: 320 °C (608 °F)
Boiling Point: 230 - 240 °C (446 - 464 °F)
Color: colorless
Density: 0.9 g/cm3 @ 20 °C (68 °F)
Dynamic Viscosity: 10 - 12 mPa.s @ 20 °C (68 °F)
Flash Point: 117 °C (243 °F)
Lower Explosion Limit: 1.2 %(V)
Melting Point: -77 °C (-107 °F)
Odor: slight
Partition Coefficient:
Pow: 3.2
pH: 4.4 @ 20 °C (68 °F)
Relative Density: 0.9 @ 20 °C (68 °F) Reference Material: (water = 1)
Surface Tension: 35.3 mN/m
Vapor Pressure: 0.0034 mmHg @ 20 °C (68 °F)

Boiling Point: 253.4ºC at 760 mmHg
Density: 0.919 g/cmsup>3
InChI Key: XZOYHFBNQHPJRQ-UHFFFAOYSA-N
InChI: InChI=1S/C9H18O2/c1-8(2)6-4-3-5-7-9(10)11/h8H,3-7H2,1-2H3,(H,10,11)
Canonical SMILES: CC(C)CCCCCC(=O)O

Molecular Weight: 158.24
XLogP3: 3.3
Hydrogen Bond Donor Count: 1
Hydrogen Bond Acceptor Count: 2
Rotatable Bond Count: 6
Exact Mass: 158.130679813
Monoisotopic Mass: 158.130679813
Topological Polar Surface Area: 37.3 Ų
Heavy Atom Count: 11
Complexity: 108
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes

Specifications of Isononanoic acid:
Appearance: Clear Liquid
Color: APHA: 15 max.
Purity: Wt %: 95.0 min.
Specific Gravity: 20/20°C: 0.897 - 0.903
Acid Value: KOHmg/g: 337 min.
Water Content: Wt %: 0.10 max.

Names of Isononanoic acid:

Regulatory process names:
Isononanoic acid
isononanoic acid

IUPAC names:
7-methyloctanoic acid
Isononanoic acid
isononanoic acid

Other identifier:
26896-18-4

Synonyms of Isononanoic acid:
7-methyloctanoic acid
ISONONANOIC ACID
693-19-6
26896-18-4
Octanoic acid, 7-methyl-
Isononanoicacid
7-methyl-octanoic acid
7-methyl caprylic acid
M3MIU88L6U
7-Methyloctanoicacid
Isononansaure
isononanic acid
iso-nonanoic acid
7-Methyloctansaeure
7-Methyl-octansaeure
7-methylcaprylic acid
UNII-M3MIU88L6U
SCHEMBL254102
CHEBI:37108
DTXSID10883129
ZINC2012819
LMFA01020003
AKOS006272652
AS-56712
CS-0265355
FT-0621464
FT-0655830
EN300-97984
D93038
A836428
Q27117040
Z1198149402
221-975-0 [EINECS]
248-092-3 [EINECS]
26896-18-4 [RN]
3,5,5-Trimethylhexanoic acid [ACD/IUPAC Name]
3,5,5-Trimethylhexansäure [German] [ACD/IUPAC Name]
3302-10-1 [RN]
512-34-5 [RN]
Acide 3,5,5-triméthylhexanoïque [French] [ACD/IUPAC Name]
Hexanoic acid, 3,5,5-trimethyl- [ACD/Index Name]
Isononanoic acid
Isononanoic-Acid
QV1Y1&1X1&1&1 [WLN]
[3302-10-1] [RN]
3,5,5-TRIMETHYL HEXANOIC ACID
3,5,5-TrimethylhexanoicAcid
Hexanoic acid,3,5,5-trimethyl-

Isononanoic acid is a branched-chain saturated fatty acid consisting of octanoic acid carrying a 7-methyl group.
Isononanoic acid is a branched-chain saturated fatty acid, a medium-chain fatty acid and a methyl-branched fatty acid.
Isononanoic acid is a branched-chain fatty acid that is commonly used in the production of plasticizers, lubricants, and surfactants.

CAS: 26896-18-4
MF: C9H18O2
MW: 158.24
EINECS: 248-092-3

Isononanoic acid is also used as a raw material for the synthesis of various chemical compounds.
In recent years, there has been growing interest in the scientific research applications of INA due to Isononanoic acid's unique chemical properties and potential biological activities.
Isononanoic acid is an aliphatic carboxylic acid.
Isononanoic acid is a colorless transparent liquid with strong acid taste and pungent smell.
Isononanoic acid widely used in industries such as adhesives and coatings.

Isononanoic acid is a critical carboxylic acid intermediate.
Isononanoic acid is used in the production of polyol ester based synthetic lubricants for refrigeration or aviation.
The high and consistent purity of the product provides precise and reliable attributes to the applications.
Isononanoic acid is also used as a corrosion inhibitor in industrial fluids and coolants; as a monomer in the synthesis of alkyd resins for stoving enamels and two-component paints.

Isononanoic acid is an isomeric compound of formula C9H18O2 that serves various purposes.
Isononanoic acid is a colorless liquid that dissolves in organic solvents such as ethanol, ether, and benzene.
Isononanoic acid is used in the production of various chemicals, including esters, plasticizers, and lubricants.
Isononanoic acid is also used as a raw material in the production of coatings, adhesives, and inks.
Isononanoic acid`s similar to 3,5,5-trimethylhexanoic acid, but not totally the same in a few applications.

Uses
Isononanoic acid is mainly used as an intermediate of paint and paint drier.
Isononanoic acid is also widely used in industries such as spices, lubricants, plasticizers, etc.
Isononanoic acid used for producing esters as lubricants and plasticizers, and for producing peroxides as polymerization catalysts.
Isononanoic acid can also be used as a raw material for synthetic lubricants, metal soaps, and metal working fluids.
Isononanoic acid can also be used as anti rust additives, alkyd resins, and its metal salts can be used as stabilizers, PVC stabilizers and preservatives, as well as tire adhesion promoters;

Isononanoic acid Chemical & Physical Properties
Density: 0.919 g/cm3
Boiling Point: 253.4ºC at 760 mmHg
Molecular Formula: C9H18O2
Molecular Weight: 158.23800
Exact Mass: 158.13100
PSA: 37.30000
LogP: 2.67750
Vapour Pressure: 0.0057mmHg at 25°C
Index of Refraction: 1.439
Storage condition: 2-8°C

Synthesis Method
Isononanoic acid can be synthesized through various methods, including the catalytic hydrogenation of oleic acid, the ozonolysis of 2-ethylhexanol, and the oxidation of isononyl alcohol.
The most commonly used method is the catalytic hydrogenation of oleic acid, which involves the use of a catalyst such as palladium or nickel to convert the unsaturated fatty acid into a saturated fatty acid.

Synonyms
7-methyloctanoic acid
ISONONANOIC ACID
693-19-6
26896-18-4
Octanoic acid, 7-methyl-
Isononanoicacid
7-methyl-octanoic acid
7-methyl caprylic acid
Isononylic acid
M3MIU88L6U
EINECS 248-092-3
7-Methyloctanoicacid
Isononansaure
isononanic acid
iso-nonanoic acid
7-Methyloctansaeure
7-Methyl-octansaeure
7-methylcaprylic acid
UNII-M3MIU88L6U
SCHEMBL254102
CHEBI:37108
DTXSID10883129
XZOYHFBNQHPJRQ-UHFFFAOYSA-N
LMFA01020003
AKOS006272652
AS-56712
LS-166122
CS-0265355
FT-0621464
FT-0655830
EN300-97984
D93038
A836428
Q27117040
Z1198149402

3,5,5-TRIMETHYL HEXANOIC ACID; Isononanoic acid; 3,5,5-Trimethylhexansäure (German); ácido 3,5,5-trimetilhexanoico (Spanish); Acide 3,5,5-trimethylhexanoïque (French); cas no: 3302-10-1

Isononanoic acid technical grade (3,5,5-Trimethylhexanoic acid) is a critical carboxylic acid intermediate.
Isononanoic acid technical grade is used in the production of polyol ester based synthetic lubricants for refrigeration or aviation.


CAS Number: 26896-18-4
EC Number: 248-092-3
Chemical Name: 3,5,5-Trimethylhexanoic Acid
Chemical Family: Organic Acids, Carboxylic Acids & Derivatives
Molecular Formula: C9H18O2



3,5,5-Trimethylhexanoic Acid, i-Nonanoic acid, Isononansaure,Isononanoicaci, I-NONANOICACID, Guide Wang Sour, ISONONANOIC ACID, Methyloctanoicacid, 7-methylcaprylic acid, 7-METHYL OCTANOIC ACID, 7-Methyl-octansaeure, Glyoxylamide,N-2-naphthyl-,oxime (7CI), Acetamide,2-(hydroxyimino)-N-2-naphthalenyl,
Isonitrosoacetyl-2-naphthylamin, ISONONANOIC ACID, isononanic acid, Glyoxylamide,N-2-naphthyl-,2-oxime (8CI), (2Z)-2-HYDROXYIMINO-N-NAPHTHALEN-2-YL-ACETAMIDE, isononoic acid, 7-Methyl-octansaeure, Glyoxylamide,N-2-naphthyl-,oxime (7CI), Acetamide,2-(hydroxyimino)-N-2-naphthalenyl, Isonitrosoacetyl-2-naphthylamin, ISONONANOIC ACID, isononanic acid, Glyoxylamide,N-2-naphthyl-,2-oxime (8CI), (2Z)-2-HYDROXYIMINO-N-NAPHTHALEN-2-YL-ACETAMIDE, isononoic acid, 3,5,5-Trimethylhexanoic acid, 3302-10-1, Hexanoic acid, 3,5,5-trimethyl-, 3,5,5-trimethyl-hexanoic acid, 3,5,5-Trimethylhexanoicacid, DTXSID6029254,
AW943Q219O, NSC-52185, Isononylic acid, NSC52185, EINECS 221-975-0, NSC 52185, KYOWANOIC N, ISONONANIOC ACID, ISONONANOIC-ACID, AI3-22275, 3,5-Trimethylhexanoic acid, SCHEMBL143938, UNII-AW943Q219O, 3,5,5 trimethylhexanoic acid, Hexanoic acid,5,5-trimethyl-, DTXCID409254, ?3,5,5-Trimethylhexanoic acid, CHEMBL3182142, CHEBI:179890, EINECS 248-092-3, Tox21_200081, LMFA01020153, MFCD00020507, 3/5/5-TRIMETHYLHEXANOIC ACID, AKOS009100463, NCGC00248517-01, NCGC00257635-01, LS-13708, CAS-3302-10-1, CS-0077120, FT-0614415, T0630, EN300-24903, EC 221-975-0, F71193, Q15725607, InChI=1/C9H18O2/c1-7(5-8(10)11)6-9(2,3)4/h7H,5-6H2,1-4H3,(H,10,11),



Isononanoic acid technical grade is a mixture of isomers with a 3,5,5-trimethyl hexanoic acid content of about 90%, and is obtained by oxidation of the corresponding isononyl aldehyde.
The clear, colorless liquid, Isononanoic acid technical grade, with a faint odor is miscible with the usual organic solvents.


Isononanoic acid technical grade is a branched-chain saturated fatty acid consisting of octanoic acid carrying a 7-methyl group.
Isononanoic acid technical grade is a branched-chain saturated fatty acid, a medium-chain fatty acid and a methyl-branched fatty acid.
Isononanoic acid technical grade that is produced from both bio-based and circular feedstocks, and is ISCC PLUS certified.


Isononanoic acid technical grade has a bio-based content of over 70%, providing manufacturers with a sustainable and eco-friendly alternative to conventional isononanoic acid.
Isononanoic acid technical grade (3,5,5-Trimethylhexanoic acid) is a critical carboxylic acid intermediate.


Isononanoic acid technical grade, with the CAS registry number 26896-18-4, is also known as 7-Methyloctanoic acid.
Isononanoic acid technical grade's EINECS registry number is 248-092-3.
Isononanoic acid technical grade's molecular formula is C9H18O2 and molecular weight is 158.24.


Isononanoic acid technical grade's IUPAC name is called 7-methyloctanoic acid.
Isononanoic acid technical grade is clear, colourless liquid.
Isononanoic acid technical grade is a branched-chain saturated fatty acid consisting of octanoic acid carrying a 7-methyl group.


Isononanoic acid technical grade is a mixture of isomers with a 3,5,5-trimethyl hexanoic acid content of about 90%, and is obtained by oxidation of the corresponding isononyl aldehyde.


The clear, colorless liquid, Isononanoic acid technical grade, with a faint odor is miscible with the usual organic solvents.
Isononanoic acid technical grade is registered under the REACH Regulation and is manufactured in and / or imported to the European Economic Area, for intermediate use only.



USES and APPLICATIONS of ISONONANOIC ACID TECHNICAL GRADE:
Isononanoic acid technical grade is also used as a corrosion inhibitor in industrial fluids and coolants; and as a monomer in the synthesis of alkyd resins for stoving enamels and two-component paints.
Other Applications for Isononanoic acid technical grade include paint driers and acid chlorides.


The high and consistent purity of Isononanoic acid technical grade provides precise and reliable attributes to the applications.
Isononanoic acid technical grade is also used as a corrosion inhibitor in industrial fluids and coolants.
Isononanoic acid technical grade is used as a monomer in the synthesis of alkyd resins for stoving enamels and two-component paints.


Isononanoic acid technical grade is used as a buliding block for a diverse set of Neopolyol esters applied as lubricants.
Isononanoic acid technical grade or 3,5,5-Trimethylhexanoic acid or 7-methyloctanoic acid is used in Metal soaps, Lubricants, Surfactants, Alkyd resins, Acid chlorides, Cosmetics, Corrosion Inhibitor.


Isononanoic acid technical grade is also used as an an important raw material and intermediate used in organic Synthesis, pharmaceuticals, agro-chemicals and dyestuff.
Isononanoic acid technical grade is used in the production of polyol ester based synthetic lubricants for refrigeration or aviation.


Isononanoic acid technical grade is widely used as a metal working fluid, providing lubrication and cooling during machining processes.
Additionally, Isononanoic acid technical grade is utilized as a plasticizer, improving the flexibility and durability of plastics.
Moreover, Isononanoic acid technical grade is employed in the production of paints and coatings as a binder and solvent.


Isononanoic acid technical grade is also utilized in other industries for its emulsifying and dispersing properties.
Overall, the market for Isononanoic acid technical grade has significant potential in diverse sectors due to its versatile properties.
Except for food and agriculture, manufacturers of the Isononanoic acid technical grade market are building stable sources of revenue in the building, engineering, and construction industries (AEC).


Manufacturers are increasing their sources of personal care and cosmetics revenue by taking advantage of value-generating opportunities in Spain, Germany, and other European countries.
In cosmetics, Isononanoic acid technical grade is becoming more popular as a surfactant-emulsifying agent.


Because of this Isononanoic acid technical grade is used as a building block in the manufacture of plasticizers, PVC stabilizers, and coating drying additives.
Isononanoic acid technical grade is used for production of polyolester in synthetic lubricants, Paint dryers, Cosmetics, Surfactants, Metal soaps, and Metal cutting industries.


Isononanoic acid technical grade below 99% purity refers to a product that contains impurities or other substances in addition to the desired isononanoic acid compound.
This type may be suitable for certain applications where high purity is not a critical requirement.


On the other hand, Isononanoic acid technical grade above 99% purity indicates a product with a higher degree of refinement, ensuring a purer form of the acid.
This level of purity is often required for applications that demand stricter quality control or higher performance.


Isononanoic acid technical grade market finds applications in various sectors.
Isononanoic acid technical grade is used Plasticizers, Lubricants, Siccatives/paint driers, PVC stabilizers, PUR catalysts, Corrosion inhibition in coolants, Processing aid in the chemical and pharmaceutical industry.


Isononanoic acid technical grade is being increasingly used in the personal care industry for the production of a wide range of products such as primers, lubricants, and skin conditioning agents.
Hence, rise in demand for personal care products from across the globe is fueling the demand opportunities in the global Isononanoic acid technical grade market.


Companies operating in the Isononanoic acid technical grade market are adhering to guidelines suggested by government authorities while performing many activities such as storage and handling of their products.
For instance, enterprises are following guidelines on the hygiene measures and environment exposure controls.


Moreover, players in the Isononanoic acid technical grade market are following good manufacturing practices (GMP) at their plants.
Moreover, manufacturers are providing employees with protective suits and face shields in order to avoid non-standard processing issues.
Isononanoic acid technical grade is used in formulation or re-packing.



ISONONANOIC ACID TECHNICAL GRADE: PAVING THE WAY FOR NEXT GENERATION LUBRICANTS:
Paving the way for next generation lubricants, Isononanoic acid technical grade is a critical building block of polyol ester based synthetic lubricants especially for refrigeration lubricants.
Isononanoic acid technical grade's unique branched structure provides both stability and compatibility with non-ozone depleting and low to no global warming potential refrigeration gases, contributing to todays and tomorrow’s sustainability goals.



FUNCTIONS OF ISONONANOIC ACID TECHNICAL GRADE:
*Corrosion Inhibitor,
*Intermediate,
*Monomer



FEATURES OF ISONONANOIC ACID TECHNICAL GRADE:
*Acids,
*Corrosion Rust Inhibitor,
*Additive,
*Anti Corrosion,
*Intermediates,
*Emulsifier



ISONONANOIC ACID TECHNICAL GRADE MARKET: KEY FINDINGS
Due to improving spending power & changing lifestyles of major consumers around the world and increasing understanding on the availability of different types of skincare products, there has been surge in the demand for skincare as well as cosmetic products, wherein Isononanoic acid technical grade is one of the vital ingredients.

Hence, the thriving cosmetic and personal care industries are propelling the global Isononanoic acid technical grade market.
Isononanoic acid technical grade is widely utilized in the manufacturing of lubricants, cleansing agents, and detergents.

Thus, rise in demand for these products fuels growth opportunities in the market.
Moreover, rise in the demand for Isononanoic acid technical grade in a wide range of sectors, including industrial and institutional cleaning, agriculture, and aviation is leading to revenue-generation opportunities in the isononanoic acid market.



ISONONANOIC ACID TECHNICAL GRADE MARKET DEFINITION:
Isononanoic acid technical grade market is an important carboxylic acid intermediate.
Isononanoic acid technical grade is used in the production of synthetic polyol ester-based lubricants for freezing or aviation.

The high consistent purity of Isononanoic acid technical grade gives the application accurate and reliable attributes.
Isononanoic acid technical grade is also utilized as a corrosion inhibitor in industrial fluids and coolants, and as a monomer in the manufacture of alkyd resins for stove enamels and two-component paints.



ISONONANOIC ACID TECHNICAL GRADE MARKET ANALYSES AND FORECASTS THE MARKET SIZE, IN TERMS OF VALUE:
Further, the Isononanoic acid technical grade Market is segmented by Grade, Application, End-Use, and geography.
Based on Grade, the Isononanoic acid technical grade Market is segmented under Industrial, Cosmetic, and Food.

Based on the Application, the Isononanoic acid technical grade Market is segmented under the Skin Conditioning Agents, Cleansing Agents, Primers, Detergents, Lubrication, and Others.
Based on the End-Use, the Isononanoic acid technical grade Market is segmented under the Cosmetics & Personal Care, Food, Agriculture, Paints & Coatings,
Household & Industrial Cleaning, and Others.
By geography, the market covers the following regions: North America, Europe, Asia-Pacific, South America, and Middle East & Africa.
The market sizing and forecasts of Isononanoic acid technical grade have been done for each segment based on value (in USD Million).



ISONONANOIC ACID TECHNICAL GRADE MARKET DYNAMICS:
Growth in Demand for Cosmetics and Personal Care Products
The increasing population is also growing demand for cosmetics and personal care products in a few years.
The use of personal care products is expected to grow with the growth of the world’s population.

Isononanoic acid technical grade is increasingly used in the personal care business to make primers, lubricants, and skin conditioning treatments.
The increase in demand across the world for personal care products is fuelling the demand for the global isononanoic acid market.
The consumer’s improved lifestyles and increased disposable income are anticipated to fuel the demand for personal care products around the world.



MARKET OVERVIEW OF ISONONANOIC ACID TECHNICAL GRADE:
Isononanoic acid technical grade is a type of organic acid that is widely used in the production of various chemicals and materials.
Isononanoic acid technical grade is primarily used as a raw material for the production of lubricants, esters, and synthetic fibers.
Isononanoic acid technical grade is known for its excellent thermal and chemical stability, making it a popular choice in industrial applications.

The future outlook of the Isononanoic acid technical grade market is expected to be highly positive.
The increasing demand of Isononanoic acid technical grade for high-performance lubricants and synthetic fibers is driving the growth of the market.

The growth can also be attributed to the expanding automotive and textile industries, which are the major consumers of Isononanoic acid technical grade.
Additionally, the growing trend of using bio-based chemicals in various industries is expected to further boost the demand for them, as Isononanoic acid technical grade can be derived from renewable sources.

Furthermore, the current market for Isononanoic acid technical grade is witnessing steady growth.
The rising industrial production and increasing investments in infrastructure projects are fueling the demand for various chemicals, including Isononanoic acid technical grade.

Moreover, advancements in technology and research and development activities are driving innovation in the field, leading to the development of new applications and products using Isononanoic acid technical grade.

The market is projected to experience a compound annual growth rate (CAGR) of % during the forecasted period.
This growth can be attributed to the increasing industrial activities and the rising demand for high-performing materials in various sectors.

However, challenges such as fluctuating raw material prices and stringent government regulations may hinder the market growth.
Overall, the future looks promising for the industrial grade Isononanoic acid technical grade market, with significant opportunities for expansion and innovation.



PHYSICAL PROPERTIES OF ISONONANOIC ACID TECHNICAL GRADE:
(1)ACD/LogP: 3.25;
(2)# of Rule of 5 Violations: 0;
(3)ACD/LogD (pH 5.5): 2.46;
(4)ACD/LogD (pH 7.4): 0.66;
(5)ACD/BCF (pH 5.5): 27.89;
(6)ACD/BCF (pH 7.4): 1;
(7)ACD/KOC (pH 5.5): 224.1;
(8)ACD/KOC (pH 7.4): 3.6;
(9)#H bond acceptors: 2;
(10)#H bond donors: 1;
(11)#Freely Rotating Bonds: 6;
(12)Index of Refraction: 1.439;
(13)Molar Refractivity: 45.26 cm3;
(14)Molar Volume: 172 cm3;
(15)Surface Tension: 32 dyne/cm;
(16)Density: 0.919 g/cm3;
(17)Flash Point: 129.7 °C;
(18)Enthalpy of Vaporization: 54.04 kJ/mol;
(19)Boiling Point: 253.4 °C at 760 mmHg;
(20)Vapour Pressure: 0.0057 mmHg at 25°C.



PHYSICAL and CHEMICAL PROPERTIES of ISONONANOIC ACID TECHNICAL GRADE:
Grade: Technical
Form: Liquid
Appearance: liquid
Auto Ignition Temperature: 320 °C (608 °F)
Boiling Point: 230 - 240 °C (446 - 464 °F)
Color: colorless
Density: 0.9 g/cm3 @ 20 °C (68 °F)
Dynamic Viscosity: 10 - 12 mPa.s @ 20 °C (68 °F)
Flash Point: 117 °C (243 °F)
Lower Explosion Limit: 1.2 %(V)
Melting Point: -77 °C (-107 °F)
Odor: slight
Partition Coefficient
Pow: 3.2
pH: 4.4 @ 20 °C (68 °F)
Relative Density: 0.9 @ 20 °C (68 °F)

Reference Material: (water = 1)
Surface Tension: 35.3 mN/m
Vapor Pressure: 0.0034 mmHg @ 20 °C (68 °F)
CBNumber:CB6412681
Molecular Formula:C9H18O2
Molecular Weight:158.24
MDL Number:MFCD00055380
MOL File:26896-18-4.mol
Density: 0.919 g/cm3
Boiling Point: 253.4ºC at 760 mmHg
Molecular Formula: C9H18O2
Molecular Weight: 158.23800
Flash Point: 129.7ºC
Exact Mass: 158.13100
PSA: 37.30000
LogP: 2.67750

CAS Number: 693-19-6
Molecular Weight: 158.23800
Density: 0.919 g/cm3
Boiling Point: 253.4ºC at 760 mmHg
Molecular Formula: C9H18O2
Melting Point: N/A
Flash Point: 129.7ºC
Appearance: Clear liquid.
Assay: 96% to 104%
Acid Value: 337 KOH mg/g minimum.
Water: 0.1% maximum.
Relative density: about 0.9
Melting point: -70C literature.
Boiling point: 230C to 232C literature.
Flash point: 125C.
Solubility: Miscible with the usual organic solvents.

Very slightly soluble in water.
Formula: C9H18O2
Molecular Weight: 158.2
Acid Value: 340mg KOHmg/g (min)
Purity: 99% (min)
Color (Pt-Co): 20 (max)
Density at 20°C g/cm3: 0.90~0. 92
Boiling Point, °C at 760mm Hg: 228
Closed Cup Flash Point °C: 130
Refractive Index: 1.427 n (20°C/D)
Moisture Content: 0.1 wt % (max)
Molecular Weight: 158.24 g/mol
XLogP3-AA: 2.8
Hydrogen Bond Donor Count: 1

Hydrogen Bond Acceptor Count: 2
Rotatable Bond Count: 4
Exact Mass: 158.130679813 g/mol
Monoisotopic Mass: 158.130679813 g/mol
Topological Polar Surface Area: 37.3Ų
Heavy Atom Count: 11
Formal Charge: 0
Complexity: 133
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 1
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes



FIRST AID MEASURES of ISONONANOIC ACID TECHNICAL GRADE:
-Description of first-aid measures:
*If inhaled:
If breathed in, move person into fresh air.
*In case of skin contact:
Wash off with soap and plenty of water.
*In case of eye contact:
Flush eyes with water as a precaution.
*If swallowed:
Never give anything by mouth to an unconscious person. Rinse mouth with water.
-Indication of any immediate medical attention and special treatment needed:
No data available



ACCIDENTAL RELEASE MEASURES of ISONONANOIC ACID TECHNICAL GRADE:
-Environmental precautions:
Do not let product enter drains.
-Methods and materials for containment and cleaning up:
Keep in suitable, closed containers for disposal.



FIRE FIGHTING MEASURES of ISONONANOIC ACID TECHNICAL GRADE:
-Extinguishing media:
*Suitable extinguishing media:
Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide.
-Further information:
No data available



EXPOSURE CONTROLS/PERSONAL PROTECTION of ISONONANOIC ACID TECHNICAL GRADE:
-Control parameters:
--Ingredients with workplace control parameters:
-Exposure controls:
--Personal protective equipment:
*Eye/face protection:
Use equipment for eye protection.
*Skin protection:
Handle with gloves.
Wash and dry hands.
*Body Protection:
Impervious clothing
*Respiratory protection:
Respiratory protection not required.
-Control of environmental exposure:
Do not let product enter drains.



HANDLING and STORAGE of ISONONANOIC ACID TECHNICAL GRADE:
-Conditions for safe storage, including any incompatibilities:
*Storage conditions:
Store in cool place.
Keep container tightly closed in a dry and well-ventilated place.
Containers which are opened must be carefully resealed and kept upright to prevent leakage.



STABILITY and REACTIVITY of ISONONANOIC ACID TECHNICAL GRADE:
-Reactivity:
No data available
-Chemical stability:
Stable under recommended storage conditions.
-Possibility of hazardous reactions:
No data available
-Conditions to avoid:
No data available

ISONONYL ISONONANOATE, N° CAS : 59219-71-5 / 42131-25-9. Nom INCI : ISONONYL ISONONANOATE. Nom chimique : 3,5,5-Trimethylhexyl 3,5,5-trimethylhexanoate, N° EINECS/ELINCS : 261-665-2 / -, Ses fonctions (INCI): Antistatique : Réduit l'électricité statique en neutralisant la charge électrique sur une surface. Emollient : Adoucit et assouplit la peau. Agent d'entretien de la peau : Maintient la peau en bon état

ONANOATE, N° CAS : 59219-71-5 / 42131-25-9, ISONONYL ISONONANOATE. Nom chimique : 3,5,5-Trimethylhexyl 3,5,5-trimethylhexanoate, Ses fonctions (INCI). Antistatique : Réduit l'électricité statique en neutralisant la charge électrique sur une surface. Emollient : Adoucit et assouplit la peau. Agent d'entretien de la peau : Maintient la peau en bon état

Isononyl isononanoate is an emollient ester with a rich and creamy but non-greasy feel.
Isononyl isononanoate softens the skin.
The esters of nonanoic acid occur naturally in the oil of pelargonium, a group of flowering plants.

CAS: 59219-71-5
MF: C18H36O2
MW: 284.48
EINECS: 261-665-2

Synonyms
3,5,5-Trimethylhexyl 3,5,5-trimethylcaproat;Fluka 3,5,5-Trimethylhexyl 3,5,5-trimethylhexanoate;3,5,5-Trimethylhexanoic acid 3,5,5-trimethylhexyl ester;3,5,5-Trimethyl-1-hexyl 3,5,5-trimethylhexanoate;Einecs 261-665-2;3 5 5-TRIMETHYLHEXYL 3 5 5-TRIMETHYL-;Hexanoicacid,3,5,5-trimethyl-,3,5,5-trimethylhexylester;isononylisononanoate
;3,5,5-Trimethylhexyl 3,5,5-trimethylhexanoate;59219-71-5;Tegosoft Ini
;Dermol 99;Hexanoic acid, 3,5,5-trimethyl-, 3,5,5-trimethylhexyl ester;Hatcol 5131;S4V5BS6GCX;Isononanoic acid, isononyl ester;3 5 5-TRIMETHYLHEXYL 3 5 5-TRIMETHYL-;3,5,5-Trimethylhexyl-3,5,5-trimethylhexanoate;EINECS 261-665-2;UNII-S4V5BS6GCX;SALACOS 99;LANOL 99;SCHEMBL579240;3,5,5-Trimethyl-1-hexyl 3,5,5-trimethylhexanoate;KAK 99;3,5,5-trimethylhexanoic acid 3,5,5-trimethylhexyl ester;DTXSID80866747;Isononyl 3,5,5 trimethylhexanoate;AKOS015902988;ISONONYL ISONONANOATE [WHO-DD];DB-356637;NS00013782;EC 609-993-0;A832937;J-200154;Q27288595;3,5,5-trimethylhexanoic acid-3,5,5-trimethylhexyl ester

Isononyl isononanoate has unique characteristics including extremely low freeze point, low viscosity, and excellent solubility and compatibility in a variety of ingredients such as esters, volatile silicones, mineral, and vegetable oils.
Isononyl isononanoate in skin care helps to maintain the skin’s softness and plasticity while forming a semi-occlusive film that moisturizes the skin, reduces the itchy sensation of dry skin, and improves the stratum corneum, which is the outermost layer of the skin by preventing the evaporation of the skin’s natural moisture.
Isononyl isononanoate also functions as an antistatic agent which reduces static electricity and prevents the hair or skin to be electrically charged.

Isononyl isononanoate is used in cosmetic products like lipsticks, foundation, blush, concealer, serums, nail polish, gloss, shampoos, etc.
Isononyl isononanoate is typically used in cosmetics in concentrations between 2-10%.
Skin care: Isononyl isononanoate works as an emollient and a texture enhancer of the formulation.
As an emollient, isononyl isononanoate is often found in creams, lotions, and facial moisturizers.
As a texture enhancer, isononyl isononanoate offers superior spreadability and a dry touch feel.
Isononyl isononanoate gives skincare products a distinctive velvety feel.
Additionally, Isononyl isononanoate acts as a replacement for volatile silicones in antiperspirants where it reduces tackiness and prevents clogging in aerosols.

Hair care: Isononyl isononanoate works as an antistatic agent.
Isononyl isononanoate further reduces the tangling of hair by smoothing and flattening the cuticle surface, which can also add shine and gloss to the hair.
Isononyl isononanoate leaves the hair feeling soft and silky without weighing it down or making it feel greasy.

A methyl-branched fatty acid that is Isooctadecanoic acid substituted by a methyl group at position 16.
Isooctadecanoic acidis a methyl-branched fatty acid that is heptadecanoic acid (margaric acid) substituted by a methyl group at position 16.
Isooctadecanoic acid is a branched-chain saturated fatty acid, a long-chain fatty acid and a methyl-branched fatty acid.

CAS: 30399-84-9, 2724-58-5
MF: C18H36O2
MW: 284.48
EINECS: 220-336-3

Isooctadecanoic acid is functionally related to a heptadecanoic acid.
Isooctadecanoic acid is a lightly-branched, liquid fatty acid produced by the reaction of oleic acid with a natural mineral catalyst – there is no chemical addition in this reaction, Isooctadecanoic acid is based 100% on the parent oil or fat.
Isooctadecanoic acid is used in applications which require a liquid fatty acid with exceptional stability: thermal stability in the case of a lubricant, odour stability for a cosmetic formulation, and oxidation stability for products with long shelf-life requirements.
The branching structure of Isooctadecanoic acid also enhances its dispersing power, and it is used in cosmetic and industrial applications for the stabilisation of pigments and mineral particles in oils and solvents.

Isooctadecanoic acid is a fatty acid that is used as an emollient in pharmaceutical preparations.
Isooctadecanoic acid has been shown to have skin-moisturizing and anti-inflammatory properties, which are due to its ability to inhibit the activity of phospholipase A2.
Isooctadecanoic acid also has a high degree of chemical stability and adsorption capacity.
Its adsorption mechanism is not yet well understood, but Isooctadecanoic acid appears to be related to its hydroxyl group.
Isooctadecanoic acid has been used successfully in the treatment of congestive heart failure and can prevent the accumulation of lipids on the surface of blood vessels, thereby reducing atherosclerosis.
Isooctadecanoic acid also functions as a substrate for the synthesis of isovaleric acid, which can be used as a fragrance ingredient in cosmetic products.

Isooctadecanoic acid Chemical Properties
Melting point: 67.8-68.5 °C
Boiling point: 369.53°C (estimate)
Density: 0.89 g/mL at 25 °C(lit.)
Refractive index: 1.4440 (estimate)
Storage temp.: 2-8°C
pka: 4.78±0.10(Predicted)
Form: Liquid
Odor: Typical
Stability: Stable. Combustible. Incompatible with bases, strong oxidizing agents.
LogP: 7.674 (est)

Uses
Similar to stearic or oleic acids.
Isooctadecanoic acid is used in the synthesis of methyl-branched poly(hydroxyalkanoate)s, biosurfactants and silver nanoparticles.
Isooctadecanoic acid is a useful synthetic intermediate.
Isooctadecanoic acid is used in the synthesis of methyl-branched poly(hydroxyalkanoate)s, biosurfactants and silver nanoparticles.

Synonyms
ISOSTEARIC ACID
Isooctadecanoic acid
16-METHYLHEPTADECANOIC ACID
2724-58-5
30399-84-9
Prisorine 3509
Heptadecanoic acid, 16-methyl-
16-methyl margaric acid
16-methyl-heptadecanoic acid
LZM5XA0ILL
UNII-LZM5XA0ILL
EINECS 220-336-3
CHEBI:84896
(+)-Isostearic acid
16-methylmargaric acid
DSSTox_CID_7963
EMERSOL 873
DSSTox_RID_78624
DSSTox_GSID_27963
SCHEMBL15489
CHEMBL1865303
DTXSID1040790
16-METHYLHEPTADECANOICACID
Tox21_302276
LMFA01020014
HY-W127433
NCGC00164392-01
NCGC00164392-02
NCGC00255115-01
AS-57253
Isostearic acid, >=97% (capillary GC)
LS-74183
CAS-30399-84-9
CS-0185665
C20356
D92986
J-016709
W-109211
Q27158161

DESCRIPTION

Isostearic acid, also known as iso-octadecanoic acid, is an branched saturated fatty acid derived from vegetable oils.
With the chemical formula of CH3(CH2)14COOH and CAS number30399-84-9 / 2724-58-5, it appears as a waxy white solid at room temperature.
Compared to straight-chain stearic acid, isostearic acid contains a methyl branch on its carbon chain that gives it exceptional properties.

CAS Number: 2724-58-5
EINECS: 220-336-3

The methyl branch results in a lower melting point (around 52-55°C) and imparts greater solubility in oil phases.
Isooctadecanoic Acid (Isostearic Acid) also exhibits superior viscosity characteristics.:


Isooctadecanoic Acid (Isostearic Acid) is a lightly-branched, liquid fatty acid produced by the reaction of oleic acid with a natural mineral catalyst – there is no chemical addition in this reaction, isostearic acid is based 100% on the parent oil or fat.
Isooctadecanoic Acid (Isostearic Acid) is used in applications which require a liquid fatty acid with exceptional stability: thermal stability in the case of a lubricant, odour stability for a cosmetic formulation, and oxidation stability for products with long shelf-life requirements.
The branching structure of isostearic acid also enhances its dispersing power, and Isooctadecanoic Acid (Isostearic Acid) is used in cosmetic and industrial applications for the stabilisation of pigments and mineral particles in oils and solvents.




Isostearic acid is a fatty acid that is used as an emollient in pharmaceutical preparations.
Isostearic acid has been shown to have skin-moisturizing and anti-inflammatory properties, which are due to its ability to inhibit the activity of phospholipase A2.
Isostearic acid also has a high degree of chemical stability and adsorption capacity.

Its adsorption mechanism is not yet well understood, but it appears to be related to its hydroxyl group.
This compound has been used successfully in the treatment of congestive heart failure and can prevent the accumulation of lipids on the surface of blood vessels, thereby reducing atherosclerosis. Isostearic acid also functions as a substrate for the synthesis of isovaleric acid, which can be used as a fragrance ingredient in cosmetic products.


Isooctadecanoic Acid (Isostearic Acid) is a methyl-branched fatty acid that is heptadecanoic acid (margaric acid) substituted by a methyl group at position 16.
Isooctadecanoic Acid (Isostearic Acid) is a branched-chain saturated fatty acid, a long-chain fatty acid and a methyl-branched fatty acid.

Isooctadecanoic Acid (Isostearic Acid) is functionally related to a heptadecanoic acid.
Isooctadecanoic Acid (Isostearic Acid) is a natural product found in Aristolochia grandiflora, Streptomyces, and other organisms with data available.

Isooctadecanoic Acid (Isostearic Acid) is a fatty acid molecule with an 18-carbon atom chain backbone.
Isooctadecanoic Acid (Isostearic Acid) is an isomer of stearic acid, meaning that they both have a chemical formula of C18H36O2, but differ in the arrangement of their atoms.
While stearic acid has a linear carbon chain with 18 carbon atoms, isosteric acid as a carbon chain with 17 atoms and a single carbon branch at the 16th carbon atom.

Its chemical structure can be represented as (CH3)2CH(CH2)14CO2H.
Isooctadecanoic Acid (Isostearic Acid) is found naturally in meat products and vegetable oils.
Isooctadecanoic Acid (Isostearic Acid) has a wide range of industrial uses.
Isooctadecanoic Acid (Isostearic Acid) is mainly used as an additive in adhesives or lubricants for both paints and personal care products






USES OF ISOOCTADECANOIC ACID (ISOSTEARIC ACID):
Isooctadecanoic Acid (Isostearic Acid) is Mainly used as cosmetic raw materials.
Isooctadecanoic Acid (Isostearic Acid) is also used for lubricating oil, plastic processing lubricant and various lipids.

Because of it owned branch chain, its melting point is lower than stearic acid, and it has good performance works at low temperature.
Its various lipids are highly resistant to alkali, and they can play best characteristics when used in alkaline emulsification systems.

Its features make them attractive additives in the field of engine and gear lubricants.
Owned features : low pour points of acids and derivatives, good oxidative and hydrolytic stability.
Stable solubility in various solvents, low viscosity of organic solvent solutions and good lubricity, etc.
Isooctadecanoic Acid (Isostearic Acid) is a substitute for naphthenic acid and 7-9 acid in ion exchange extraction, environmental friendly and non-polluting.



Isooctadecanoic Acid (Isostearic Acid) is chemically, a carboxyl group attached to alkyl chain, methylated, branched at various carbons makes it much more stable compared to other linear chain fatty acids, including oxidation potential.
Isooctadecanoic Acid (Isostearic Acid) can be used as a lubricant, that can improve flow of a powder mixture.

Isooctadecanoic Acid (Isostearic Acid) has excellent spreadability without oiliness, that can be easily used in a cosmetic which not only moisturizes skin but also does not leave any oily feel.
However, in cosmetic formulation it is used as a binder to form cake-like compact powder or eye shadow.

Isooctadecanoic Acid (Isostearic Acid) is also used in cleansing and emulsifying agent, because of presence of both ionic and nonionic groups.
Isooctadecanoic Acid (Isostearic Acid) is used in varieties of cosmetic and personal care products.



APPLICATIONS OF ISOOCTADECANOIC ACID (ISOSTEARIC ACID):
In Personal Care And Cosmetics:
The excellent solubility of isostearic acid makes it an ideal emollient and thickening agent in cosmetic formulations.
Isostearic acid provides a smooth, silky feel to creams and lotions.

Isostearic acid is commonly used in lipsticks and balms due to its glossy texture.
Isostearic acid also functions as an effective lubricant and moisturizer in shaving creams and aftershaves.


INDUSTRIAL USES OF ISOOCTADECANOIC ACID (ISOSTEARIC ACID):
The lubricating properties of isostearic acid are harnessed for metalworking fluids and lubricating greases.
Isooctadecanoic Acid (Isostearic Acid) is also utilized as a softener for plastics and synthetic rubbers. Isostearic acid can help adjust the viscosity index of lubricating oils.
In soaps and detergents, Isooctadecanoic Acid (Isostearic Acid) acts as a lime soap dispersant.

With its superior solubility, emolliency and customizable formulability, isostearic acid has diverse applications across cosmetics, toiletries, industrial lubricants and more.
Its branched structure unlocks enhanced functional performance.
As a plant-based specialty chemical, isostearic acid enables the development of sustainable and highly effective products.


STORAGE OF ISOOCTADECANOIC ACID (ISOSTEARIC ACID):
Containers of this material may be hazardous when empty since they retain product residues (vapors, liquid)
Do not store at a temperature exceeding 80 °c
Observe all warnings and precautions listed for the product

Outside or detached storage is recommended
Polymerization or oxidation of the unsaturated bonds may occur
Store in a dry, cool, well-ventilated area

Store in the dark
Use only containers, joints, pipes, etc., made in a material suitable for use with fatty acids



SAFETY INFORMATION ABOUT ISOOCTADECANOIC ACID (ISOSTEARIC ACID):
First aid measures:
Description of first aid measures:
General advice:
Consult a physician.
Show this safety data sheet to the doctor in attendance.
Move out of dangerous area:

If inhaled:
If breathed in, move person into fresh air.
If not breathing, give artificial respiration.
Consult a physician.
In case of skin contact:
Take off contaminated clothing and shoes immediately.
Wash off with soap and plenty of water.
Consult a physician.

In case of eye contact:
Rinse thoroughly with plenty of water for at least 15 minutes and consult a physician.
Continue rinsing eyes during transport to hospital.

If swallowed:
Do NOT induce vomiting.
Never give anything by mouth to an unconscious person.
Rinse mouth with water.
Consult a physician.

Firefighting measures:
Extinguishing media:
Suitable extinguishing media:
Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide.
Special hazards arising from the substance or mixture
Carbon oxides, Nitrogen oxides (NOx), Hydrogen chloride gas

Advice for firefighters:
Wear self-contained breathing apparatus for firefighting if necessary.
Accidental release measures:
Personal precautions, protective equipment and emergency procedures
Use personal protective equipment.

Avoid breathing vapours, mist or gas.
Evacuate personnel to safe areas.

Environmental precautions:
Prevent further leakage or spillage if safe to do so.
Do not let product enter drains.
Discharge into the environment must be avoided.

Methods and materials for containment and cleaning up:
Soak up with inert absorbent material and dispose of as hazardous waste.
Keep in suitable, closed containers for disposal.

Handling and storage:
Precautions for safe handling:
Avoid inhalation of vapour or mist.

Conditions for safe storage, including any incompatibilities:
Keep container tightly closed in a dry and well-ventilated place.
Containers which are opened must be carefully resealed and kept upright to prevent leakage.
Storage class (TRGS 510): 8A: Combustible, corrosive hazardous materials

Exposure controls/personal protection:
Control parameters:
Components with workplace control parameters
Contains no substances with occupational exposure limit values.
Exposure controls:
Appropriate engineering controls:
Handle in accordance with good industrial hygiene and safety practice.
Wash hands before breaks and at the end of workday.

Personal protective equipment:
Eye/face protection:
Tightly fitting safety goggles.
Faceshield (8-inch minimum).
Use equipment for eye protection tested and approved under appropriate government standards such as NIOSH (US) or EN 166(EU).

Skin protection:
Handle with gloves.
Gloves must be inspected prior to use.
Use proper glove
removal technique (without touching glove's outer surface) to avoid skin contact with this product.
Dispose of contaminated gloves after use in accordance with applicable laws and good laboratory practices.
Wash and dry hands.

Full contact:
Material: Nitrile rubber
Minimum layer thickness: 0.11 mm
Break through time: 480 min
Material tested:Dermatril (KCL 740 / Aldrich Z677272, Size M)
Splash contact
Material: Nitrile rubber
Minimum layer thickness: 0.11 mm
Break through time: 480 min
Material tested:Dermatril (KCL 740 / Aldrich Z677272, Size M)
It should not be construed as offering an approval for any specific use scenario.

Body Protection:
Complete suit protecting against chemicals, The type of protective equipment must be selected according to the concentration and amount of the dangerous substance at the specific workplace.
Respiratory protection:
Where risk assessment shows air-purifying respirators are appropriate use a fullface respirator with multi-purpose combination (US) or type ABEK (EN 14387) respirator cartridges as a backup to engineering controls.

If the respirator is the sole means of protection, use a full-face supplied air respirator.
Use respirators and components tested and approved under appropriate government standards such as NIOSH (US) or CEN (EU).
Control of environmental exposure
Prevent further leakage or spillage if safe to do so.
Do not let product enter drains.
Discharge into the environment must be avoided.

Stability and reactivity:
Chemical stability:
Stable under recommended storage conditions.
Incompatible materials:
Strong oxidizing agents:
Hazardous decomposition products:
Hazardous decomposition products formed under fire conditions.
Carbon oxides, Nitrogen oxides (NOx), Hydrogen chloride gas.

Disposal considerations:
Waste treatment methods:
Product:
Offer surplus and non-recyclable solutions to a licensed disposal company.
Contact a licensed professional waste disposal service to dispose of this material.
Contaminated packaging:
Dispose of as unused product









CHEMICAL AND PHYSICAL PROPERTIES OF ISOOCTADECANOIC ACID (ISOSTEARIC ACID):
XlogP3: 7.20 (est)
Molecular Weight: 284.48332000
Formula: C18 H36 O2
Appearance: white solid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 400.00 to 401.00 °C. @ 760.00 mm Hg (est)
Flash Point: 438.00 °F. TCC ( 225.70 °C. ) (est)
logP (o/w): 7.674 (est)
Soluble in:
water, 0.007116 mg/L @ 25 °C (est)
Molecular Weight
284.5 g/mol
XLogP3
7.2
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
15
Exact Mass
284.271530387 g/mol
Monoisotopic Mass
284.271530387 g/mol
Topological Polar Surface Area
37.3Ų
Heavy Atom Count
20
Formal Charge
0
Complexity
212
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes


SYNONYMS OF ISOOCTADECANOIC ACID (ISOSTEARIC ACID):
2-methyl-heptadecanoic acid
isostearate
isostearic acid
ISOSTEARIC ACID
Isooctadecanoic acid
16-METHYLHEPTADECANOIC ACID
2724-58-5
30399-84-9
Prisorine 3509
Heptadecanoic acid, 16-methyl-
16-methyl margaric acid
16-methyl-heptadecanoic acid
LZM5XA0ILL
CHEBI:84896
(+)-Isostearic acid
UNII-LZM5XA0ILL
EINECS 220-336-3
16-methylmargaric acid
DSSTox_CID_7963
EMERSOL 873
DSSTox_RID_78624
DSSTox_GSID_27963
SCHEMBL15489
CHEMBL1865303
DTXSID1040790
16-METHYLHEPTADECANOICACID
XDOFQFKRPWOURC-UHFFFAOYSA-N
Tox21_302276
LMFA01020014
HY-W127433
NCGC00164392-01
NCGC00164392-02
NCGC00255115-01
AS-57253
Isostearic acid, >=97% (capillary GC)
CAS-30399-84-9
CS-0185665
C20356
D92986
J-016709
W-109211
Q27158161

Isostearic acid, also known as isooctadecanoic acid, is a type of fatty acid derived from the isomerization of oleic acid.
Oleic acid is a monounsaturated omega-9 fatty acid commonly found in various vegetable oils.
Isooctadecanoic acid (Isostearic Acid) undergoes a process called isomerization, resulting in a mixture of branched-chain isomers of stearic acid, which is a saturated fatty acid with an 18-carbon chain.

CAS Number: 30399-84-9
EC Number: 250-178-0

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APPLICATIONS


Isooctadecanoic acid (Isostearic Acid) is commonly used in skincare products, such as creams and lotions, for its emollient properties.
Isooctadecanoic acid (Isostearic Acid) is a key ingredient in lip balms and lipsticks, contributing to their smooth texture and spreadability.
Isooctadecanoic acid (Isostearic Acid) enhances the adherence and texture of makeup products, including foundations and eyeshadows.

Its compatibility makes it valuable in sunscreen formulations, contributing to the product's texture and application.
Isooctadecanoic acid (Isostearic Acid) is used to stabilize emulsions in cosmetic products like creams and serums.

Widely employed in the personal care industry, isostearic acid enhances the overall sensory experience of products.
Its unique properties make it suitable for certain industrial applications, particularly in the formulation of lubricants.
Isooctadecanoic acid (Isostearic Acid) is utilized in the production of biodegradable and environmentally friendly products.

Isooctadecanoic acid (Isostearic Acid) is incorporated into the formulation of hydrating facial mists, providing a refreshing and moisturizing experience.
Isooctadecanoic acid (Isostearic Acid) helps disperse active ingredients evenly in sunscreen sprays for optimal sun protection.
Isooctadecanoic acid (Isostearic Acid) is used in the formulation of cuticle creams and nail care products, promoting nail health.

Isooctadecanoic acid (Isostearic Acid) serves as a softening agent in the textile industry, enhancing the feel and drape of fabrics.
Included in anti-aging creams and serums, isostearic acid contributes to their effectiveness.
Its compatibility with various solvents makes it suitable for use in the formulation of inkjet printing inks.

Isooctadecanoic acid (Isostearic Acid) contributes to the formulation of massage oils, providing a smooth and lubricating texture.
Isooctadecanoic acid (Isostearic Acid) is used in the production of metalworking fluids, offering lubrication and cooling properties during machining.
Isooctadecanoic acid (Isostearic Acid) finds use in the formulation of waterproof coatings for outdoor fabrics and materials.

Isooctadecanoic acid (Isostearic Acid) is incorporated into adhesive formulations, contributing to viscosity and tackiness.
Isooctadecanoic acid (Isostearic Acid) is employed in the production of specialty soaps, contributing to lathering properties and skin-feel.
Isooctadecanoic acid (Isostearic Acid) is used in the formulation of biodegradable hydraulic fluids for certain industrial applications.

In candle manufacturing, isostearic acid aids in controlling the melting point and improving burn quality.
Isooctadecanoic acid (Isostearic Acid) is utilized in the creation of personal lubricants, providing a smooth and non-irritating experience.
Isooctadecanoic acid (Isostearic Acid) is added to certain polymer formulations to modify rheological properties and improve processing.

Isooctadecanoic acid (Isostearic Acid) is used in the production of wire drawing compounds for metalworking processes.
Isooctadecanoic acid (Isostearic Acid) is included in the formulation of wood finishes, providing water-repellent properties and enhancing durability.

Isooctadecanoic acid (Isostearic Acid) is employed in the production of anti-fogging agents for eyewear and mirrors, preventing condensation.
Isooctadecanoic acid (Isostearic Acid) serves as a polymer modifier, influencing the properties of certain plastics and enhancing their performance.

Isooctadecanoic acid (Isostearic Acid) contributes to the fragrance release and texture of candle wax melts.
In addition to industrial lubricants, isostearic acid is used in the formulation of biodegradable and eco-friendly lubricants.

Isooctadecanoic acid (Isostearic Acid) is applied in the production of release agents, facilitating the easy release of molded products.
Isooctadecanoic acid (Isostearic Acid) is suitable for use in the creation of cold-weather lubricants, maintaining functionality in low temperatures.
Isooctadecanoic acid (Isostearic Acid) finds application in the development of rust preventatives and corrosion inhibitors for metal surfaces.

The film-forming characteristics of isostearic acid are utilized in the creation of thin films in certain formulations.
Specialty coatings for electronic components benefit from isostearic acid, providing protection against environmental factors.
Isooctadecanoic acid (Isostearic Acid) is used in wire and cable lubrication to reduce friction during processing.

Isooctadecanoic acid (Isostearic Acid) contributes to the formulation of biodegradable cutting fluids, enhancing the machining process.
Isooctadecanoic acid (Isostearic Acid) is incorporated into the production of bio-based plastics, contributing to their structural properties.

Its compatibility with various printing processes makes isostearic acid suitable for specialty inks.
Isooctadecanoic acid (Isostearic Acid) is applied in the formulation of water-resistant coatings for paper and cardboard.
Isooctadecanoic acid (Isostearic Acid) may serve as a food-grade lubricant in the production of confectionery items.

Isooctadecanoic acid (Isostearic Acid) contributes to the viscosity and tackiness of adhesive formulations.
Isooctadecanoic acid (Isostearic Acid) is used in the production of mold-release agents, aiding in the demolding process.

Isooctadecanoic acid (Isostearic Acid) is employed in the creation of anti-corrosion coatings for metal surfaces.
Isooctadecanoic acid (Isostearic Acid) is used in the formulation of metalworking fluids, providing lubrication and cooling properties during machining.

Isooctadecanoic acid (Isostearic Acid) is added to polymer blends to modify their rheological properties and improve processability.
Isooctadecanoic acid (Isostearic Acid) contributes to the formulation of cutting fluids used in metal machining processes.

Isooctadecanoic acid (Isostearic Acid) finds use in oil-based ink formulations as an additive, enhancing compatibility and performance.
Isooctadecanoic acid (Isostearic Acid) is incorporated into makeup primers, improving the smooth application of subsequent cosmetic products.

Isooctadecanoic acid (Isostearic Acid) contributes to the development of bio-based and sustainable coolants for certain industrial applications.
Isooctadecanoic acid (Isostearic Acid) is employed in the formulation of long-wearing cosmetics, providing transfer resistance and durability.



DESCRIPTION


Isostearic acid, also known as isooctadecanoic acid, is a type of fatty acid derived from the isomerization of oleic acid.
Oleic acid is a monounsaturated omega-9 fatty acid commonly found in various vegetable oils.
Isooctadecanoic acid (Isostearic Acid) undergoes a process called isomerization, resulting in a mixture of branched-chain isomers of stearic acid, which is a saturated fatty acid with an 18-carbon chain.

The isomerization process changes the molecular structure of oleic acid, creating a mixture of isomers with branched chains. Isostearic acid exhibits different properties compared to its straight-chain counterparts, and it is known for its emollient properties. Emollients are substances that help soften and smooth the skin, making isostearic acid a valuable ingredient in cosmetic and personal care products, such as skin creams, lotions, and lipsticks.

The chemical formula for isostearic acid is typically represented as C18H36O2, and its altered structure contributes to its unique characteristics and applications in various industries. Isostearic acid is often used for its skin-conditioning properties and is compatible with a range of cosmetic formulations.

Isostearic acid, known chemically as isooctadecanoic acid, is derived from the isomerization of oleic acid.
Featuring a branched molecular structure, isostearic acid differs significantly from its linear counterparts.
Commonly found in cosmetic formulations, isostearic acid is prized for its emollient properties.
As a versatile fatty acid, isostearic acid is often utilized in skincare products, such as lotions and creams.

The isomerization process imparts unique characteristics to isostearic acid, making it ideal for various personal care applications.
Isooctadecanoic acid (Isostearic Acid) contributes to the smooth texture and moisturizing effects of cosmetic formulations.

The altered structure of isostearic acid enhances its compatibility with the skin, providing a pleasant sensory experience.
Isooctadecanoic acid (Isostearic Acid) is a key ingredient in lip balms and lipsticks, contributing to their spreadability and texture.
Isooctadecanoic acid (Isostearic Acid) is valued for its role in stabilizing emulsions in cosmetic products.

The unique properties of isostearic acid make it suitable for improving the adherence of makeup products to the skin.
Its branched-chain structure adds a luxurious feel to skincare formulations, enhancing the overall user experience.
Isooctadecanoic acid (Isostearic Acid) is utilized in the creation of sunscreen formulations, contributing to their texture and application.

Due to its compatibility with various ingredients, isostearic acid is a preferred choice in cosmetic formulations.
The isomer-rich nature of isostearic acid is harnessed in the development of long-wearing and transfer-resistant cosmetics.
Isooctadecanoic acid (Isostearic Acid) is known for its ability to create stable and well-balanced cosmetic products.
The modified lipid chain of isostearic acid contributes to its effectiveness in certain industrial applications, such as lubricants.

In the formulation of skincare serums, isostearic acid plays a role in providing a lightweight and smooth finish.
Isooctadecanoic acid (Isostearic Acid) is commonly found in hydrating facial mists, contributing to their refreshing and moisturizing qualities.
The compatibility of isostearic acid with other cosmetic ingredients allows for the creation of innovative personal care products.

Isooctadecanoic acid (Isostearic Acid) is an essential component in the development of high-quality body lotions, delivering a soft and velvety feel.
Its use extends beyond cosmetics, finding applications in the production of environmentally friendly and biodegradable lubricants.
Isooctadecanoic acid (Isostearic Acid) is applied in the manufacturing of eco-friendly detergents, contributing to their performance and safety.

The altered triglyceride composition of isostearic acid makes it suitable for use in eco-conscious and sustainable formulations.
Isooctadecanoic acid (Isostearic Acid) is chosen for its compatibility with various solvents, making it valuable in the creation of inkjet printing inks.
The versatility of isostearic acid continues to drive innovation in the cosmetic and personal care industry, offering unique solutions for formulation challenges.



PROPERTIES


Chemical Formula: The chemical formula for isostearic acid is C18H36O2.
Molecular Weight: The molecular weight of isostearic acid is approximately 284.48 g/mol.
Structural Formula: Isostearic acid is characterized by a branched molecular structure due to the isomerization of oleic acid.
Physical State: Isostearic acid is generally found in the form of a colorless to pale yellow liquid at room temperature.
Odor: Isostearic acid may have a mild, characteristic odor.
Melting Point: The melting point of isostearic acid is around 35-40°C.
Boiling Point: The boiling point of isostearic acid is typically higher than its melting point, around 220-230°C.
Solubility: Isostearic acid is generally insoluble in water but soluble in organic solvents such as ethanol and ether.
Density: The density of isostearic acid is approximately 0.86 g/cm³.
Viscosity: Isostearic acid exhibits a moderate viscosity, contributing to its use in various formulations.
Refractive Index: The refractive index of isostearic acid is around 1.44.
Flash Point: Isostearic acid has a flash point above its boiling point, making it non-flammable.
pH: Isostearic acid is not typically associated with a specific pH value as it is often used in formulations where pH is adjusted by other ingredients.
Chemical Stability: Isostearic acid is generally stable under normal storage conditions.



FIRST AID


Inhalation:

Move to Fresh Air:
Immediately move the affected person to an area with fresh air, away from the source of isostearic acid.

Provide Respiratory Support:
If the person has difficulty breathing, administer artificial respiration or use available respiratory support equipment.

Seek Medical Attention:
Contact emergency medical services for further evaluation and treatment.
Provide information about the substance for accurate medical advice.


Skin Contact:

Remove Contaminated Clothing:
Quickly and gently remove any contaminated clothing, including shoes, and rinse the affected skin thoroughly.

Flush with Water:
Wash the affected skin with plenty of water for at least 15 minutes, ensuring complete rinsing.

Use Mild Soap:
Use a mild soap to cleanse the skin while rinsing, if available.

Seek Medical Attention:
If irritation, redness, or other symptoms persist, seek medical attention promptly.
Provide details about the exposure for appropriate medical advice.


Eye Contact:

Flush Eyes with Water:
Immediately flush the eyes with a gentle stream of lukewarm water for at least 15 minutes.
Hold the eyelids open to ensure thorough rinsing.

Remove Contact Lenses:
If applicable, remove contact lenses during eye irrigation.

Seek Medical Attention:
Obtain prompt medical attention, even if the person feels relief, as further evaluation is essential.
Ingestion:

Do NOT Induce Vomiting:
Do not induce vomiting unless instructed to do so by medical professionals.

Rinse Mouth:
If isostearic acid is swallowed, rinse the mouth with water.

Seek Medical Attention:
Contact emergency medical services or a poison control center for guidance and seek medical attention immediately.


General Advice:

Personal Protection:
Always wear appropriate personal protective equipment (PPE) when handling isostearic acid to prevent exposure.

Medical Attention:
Seek medical attention promptly for any signs of adverse effects, even if they appear minor.

Note to Healthcare Providers:
Provide healthcare providers with information about the substance for accurate diagnosis and treatment.

Follow-Up:
Follow any specific first aid instructions provided by healthcare professionals.

Emergency Contacts:
Keep emergency contact numbers readily accessible in case of exposure or emergencies.

Decontamination:
Properly decontaminate clothing and equipment before re-use to prevent further exposure.

Symptom Management:
Manage symptoms as advised by medical professionals, and report any lingering effects.

Monitoring:
Monitor the individual for any delayed or secondary symptoms and seek medical attention if necessary.



HANDLING AND STORAGE


Handling:

Personal Protective Equipment (PPE):
Always wear appropriate PPE, including gloves, protective eyewear, and suitable clothing, when handling isostearic acid.

Ventilation:
Work in a well-ventilated area or use local exhaust ventilation to minimize inhalation exposure.
Ensure adequate ventilation in confined spaces.

Avoid Contact:
Avoid skin and eye contact with isostearic acid.
In case of contact, follow the recommended first aid measures promptly.

Hygiene Practices:
Implement good hygiene practices, including regular hand washing, to prevent unintentional exposure.

Prevent Ingestion:
Avoid eating, drinking, or smoking in areas where isostearic acid is handled to prevent accidental ingestion.

Labeling:
Clearly label containers with the identity of the substance, relevant hazard information, and appropriate safety instructions.

Training:
Provide proper training to personnel handling isostearic acid, including information on potential hazards and proper emergency procedures.

Spill Response:
Have spill response procedures in place, including the use of absorbent materials and appropriate personal protective equipment.

Equipment Inspection:
Regularly inspect and maintain equipment used for handling isostearic acid to ensure proper functioning and prevent leaks.

Avoid Mixing:
Avoid mixing isostearic acid with incompatible substances. Refer to compatibility charts and guidelines.


Storage:

Storage Location:
Store isostearic acid in a cool, dry, and well-ventilated area, away from direct sunlight and incompatible materials.

Temperature Control:
Keep storage temperatures within the recommended range to prevent product degradation or separation.

Separation:
If isostearic acid is prone to separation, store it in a manner that allows for easy remixing if needed.

Container Integrity:
Ensure the integrity of storage containers to prevent leaks or spills.
Use containers made of compatible materials.

Segregation:
Segregate isostearic acid from incompatible materials, such as strong acids, bases, or oxidizing agents.

Fire Prevention:
Store away from ignition sources and follow fire prevention measures.
Isostearic acid is generally non-flammable.

Controlled Access:
Restrict access to the storage area to authorized personnel only.

Emergency Equipment:
Keep emergency equipment, such as spill response kits and fire extinguishers, readily accessible.

Documentation:
Maintain proper documentation of storage conditions, including batch numbers, dates, and supplier information.

Regular Inspections:
Conduct regular inspections of storage areas for any signs of damage or deterioration.

Secondary Containment:
Use secondary containment measures to prevent spills from reaching the environment.

Storage Height:
Avoid storing isostearic acid at heights where it may pose a falling hazard.
Ensure stability and secure stacking.

ISOOCTYL PALMITATE, N° CAS : 1341-38-4, Nom INCI : ISOOCTYL PALMITATE; 6-methylheptyl hexadecanoate

ISOOCTYL THIOGLYCOLATE, N° CAS : 25103-09-7, Nom INCI : ISOOCTYL THIOGLYCOLATE. Nom chimique : Isooctyl mercaptoacetate, N° EINECS/ELINCS : 246-613-9. Ses fonctions (INCI): Agent bouclant ou lissant (coiffant) : Modifie la structure chimique des cheveux, pour les coiffer dans le style requis

Isophorone diamine; IPDA; aminomethyl-5;chemamminaca17;aralditehy5083;Isophorondiamin cas no: 2855-13-2

ISOPELARGONIC ACID = ISONONANOIC ACID = 7-METHYLOCTANOIC ACID


CAS Number:693-19-6
EC Number248-092-3
Molecular Formula:C9H18O2


Isopelargonic Acid is a natural product found in Solanum pennellii with data available.
Isopelargonic Acid is a branched-chain saturated fatty acid consisting of octanoic acid carrying a 7-methyl group.
Isopelargonic Acid is a branched-chain saturated fatty acid, a medium-chain fatty acid and a methyl-branched fatty acid.
Isopelargonic Acid is a colorless, high boiling liquid.


Isopelargonic Acid`s similar with 3,5,5-trimethylhexanoic acid(CAS: 3302-10-1), but not totally the same in few applications.
Isopelargonic Acid (3,5,5-Trimethylhexanoic acid) is a critical carboxylic acid intermediate.
The high and consistent purity of Isopelargonic Acid provides precise and reliable attributes to the applications.
Isopelargonic Acid is an organic compound with structural formula CH3(CH2)7CO2H.


Isopelargonic Acid is a nine-carbon fatty acid.
Isopelargonic Acid is a colorless oily liquid with an unpleasant, rancid odor.
Isopelargonic Acid is nearly insoluble in water, but very soluble in organic solvents.
The esters and salts of Isopelargonic Acid are called nonanoates.


Isopelargonic Acid's refractive index is 1.4322.
Isopelargonic Acid's critical point is at 712 K (439 °C) and 2.35 MPa.
Isopelargonic Acid is a monofunctional carboxylic acid intermediate
Paint driers based on metal salts are also produced with Isopelargonic Acid.


Isopelargonic Acid is a critical carboxylic acid used in polyol ester synthetic lubricants, as corrosion inhibitor in coolants, and also in alkyd resins and paint driers.
Isopelargonic Acid is a clear, colorless liquid with a faint odor and soluble in usual organic solvents.
This grade of Isopelargonic Acid is a mixture of isomers and is obtained by oxidation of isononyl aldehyde.
Isopelargonic Acid, also known as Isononanoic acid, is a useful research compound.


Isopelargonic Acid's molecular formula is C9H18O2 and its molecular weight is 158.24 g/mol.
Isopelargonic Acid is a branched-chain saturated fatty acid consisting of octanoic acid carrying a 7-methyl group.
Isopelargonic Acid is a branched-chain saturated fatty acid, a medium-chain fatty acid and a methyl-branched fatty acid.
Isopelargonic Acid is a colorless, high boiling liquid.
Isopelargonic Acid`s similar with 3,5,5-trimethylhexanoic acid (CAS: 3302-10-1), but not totally the same in few applications.



USES and APPLICATIONS of ISOPELARGONIC ACID:
Isopelargonic Acid is an intermediate used to prepare Nordihydrocapsaicin (N672600) which is a capsaicinoid and analog and congener of capsaicin in chili peppers.
Isopelargonic Acid is used as Neopolyol esters applied as lubricants, intermediate for metal salt, PVC plasticizer, detergent, alkyd resin acid chloride.


Isopelargonic Acid is also used as a corrosion inhibitor in industrial fluids and coolants; as a monomer in the synthesis of alkyd resins for stoving enamels and two-component paints.
Synthetic esters of Isopelargonic Acid, such as methyl nonanoate, are used as flavorings.
Isopelargonic Acid is also used in the preparation of plasticizers and lacquers.


The derivative 4-nonanoylmorpholine is an ingredient in some pepper sprays.
The ammonium salt of nonanoic acid, ammonium nonanoate, is an herbicide.
Isopelargonic Acid is commonly used in conjunction with glyphosate, a non-selective herbicide, for a quick burn-down effect in the control of weeds in turfgrass.


Lubricants: Isopelargonic Acid is used in the production of polyolester synthetic lubricants
Isopelargonic Acid esters are used as base stocks for synthetic lubricants and metalworking fluids, and as plasticizers.
Isopelargonic Acid salts are used as paint driers and as polyvinyl chloride stabilizers.
Isopelargonic Acid peroxides are used as polymerization catalysts.


Isopelargonic Acid may be more potent than valproic acid in treating seizures.
Moreover, in contrast to valproic acid, nonanoic acid exhibited no effect on HDAC inhibition, suggesting that it is unlikely to show HDAC inhibition-related teratogenicity.
Isopelargonic Acid is used as a buliding block for a diverse set of Neopolyol esters applied as lubricants.


Isopelargonic Acid`s used as Neopolyol esters applied as lubricants, intermediate for metal salt, PVC plasticizer, detergent, alkyd resin acid chloride.
Isopelargonic Acid is used intermediate for metal soap, plasticizer, detergent, alkyd resin, acid chloride and cosmetics.
Isopelargonic Acid is used in the production of polyol ester based synthetic lubricants for refrigeration or aviation.


-Cosmetics uses of Isopelargonic Acid:
*Metal soaps
*Surfactants
*Acid chlorides
*Alkyd resins
*Corrosion Inhibitor
*Lubricants


-Applications of Isopelargonic Acid:
· Plasticizers
· Lubricants
· Siccatives/paint driers
· PVC stabilizers
· PUR catalysts
· Corrosion inhibition in coolants
· Processing aid in the chemical and pharmaceutical industry


-Coatings uses of Isopelargonic Acid:
Isopelargonic Acid is used as a monomer in the synthesis of alkyd resins for stoving enamels and two-component paints (primers and topcoats).
Isopelargonic Acid brings better yellowing performance in comparison to fatty acids.



PREPARATION, OCCURRENCE, AND USES OF ISOPELARGONIC ACID:
Isopelargonic Acid occurs naturally as esters in the oil of pelargonium.
Together with azelaic acid, Isopelargonic Acid is produced industrially by ozonolysis of oleic acid.



PHYSICAL and CHEMICAL PROPERTIES of ISOPELARGONIC ACID:
Molecular Weight:158.24
Physical State :Liquid
Storage :Store at -20° C
Molecular Weight: 158.24
XLogP3: 3.3
Hydrogen Bond Donor Count: 1
Hydrogen Bond Acceptor Count: 2
Rotatable Bond Count: 6
Exact Mass: 158.130679813
Monoisotopic Mass: 158.130679813
Topological Polar Surface Area: 37.3 Ų
Heavy Atom Count: 11
Formal Charge: 0

Complexity: 108
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 253.40 °C. @ 760.00 mm Hg (est)
Flash Point: 265.00 °F. TCC ( 129.70 °C. ) (est)
logP (o/w): 3.250 (est)
Soluble in: water, 195.5 mg/L @ 25 °C (est)

Freezing Point: °C <-60
Boiling Point: °C 235
Flash Point: °C 120
Water Solubility: Gram/Liter 3
Density (Kg/Liter): 0.899
Solubility: Slightly soluble (1.1 g/L) (25 ºC)
Density: 0.919±0.06 g/cm3 (20 ºC 760 Torr)
Melting point: 3-5 ºC
Boiling point: 248 ºC (765 Torr)
Refractive index: 1.4304 (589.3 nm 21 ºC)
Flash point: 129.7±6.9 ºC
Exact Mass: 158.13100
Boiling Point: 253.4ºC at 760 mmHg
Flash Point: 129.7ºC
Density: 0.919 g/cm³

Appearance liquid: @ 20 °C (68 °F)
Colour: colourless
Odour: slightly acidic
Odour threshold: No data available
pH: 4,4 (0,1 g/l in water @ 25 °C (77 °F))
Melting point/range -77 °C (Pour point)
Boiling point/range 236 °C @ 1013 hPa
Flash point: 117 °C @ 1013 hPa
Evaporation rate: No data available
Flammability (solid, gas): Does not apply, the substance is a liquid
Lower explosion limit: 1,2 Vol %
Upper explosion limit: No data available
Vapour density: No data available

Relative density:
Values @ °C @ °F Method
0,900 20 68 DIN 51757
0,876 50 122 DIN 51757
Solubility: 0,7 g/l @ 20 °C, in water
log Pow: 3,2 @ 25 °C (77 °F)
Autoignition temperature: 415 °C @ 1009 hPa
Decomposition temperature: No data available
Viscosity 11,47 mPa*s @ 20 °C
Oxidizing properties: Does not apply, substance is not oxidising.

There are no chemical groupsassociated with oxidizing properties
Explosive properties: Does not apply, substance is not explosive.
There are no chemical groupsassociated with explosive properties
Other information:
Molecular weight: 158,23
Molecular formula: C9 H18 O2
log Koc: 2,79 @ pH 4,5 1,90 @ pH 8
Dissociation constant: pKa 4,8 @ 20 °C (68 °F)
Refractive index: 1,429 @ 20 °C
Surface tension: 35,3 mN/m (0,63 g/l @ 20°C (68°F))



FIRST AID MEASURES of ISOPELARGONIC ACID:
-Description of first aid measures
*Inhalation
Keep at rest.
Aerate with fresh air.
*Eyes:
Rinse immediately with plenty of water, also under the eyelids, for at least 15 minutes.
Remove contact lenses.
*Skin:
Wash off immediately with soap and plenty of water.
*Ingestion
Call a physician immediately.
-Indication of any immediate medical attention and special treatment needed:
*General advice:
Treat symptomatically.



ACCIDENTAL RELEASE MEASURES of ISOPELARGONIC ACID:
-Environmental precautions:
Prevent further leakage or spillage.
-Methods and material for containment and cleaning up:
*Methods for containment:
Dike spilled material, where this is possible.
*Methods for cleaning up:
Soak up with inert absorbent material.
Keep in suitable, closed containers for disposal.
Dispose of in accordance with local regulations.



FIRE FIGHTING MEASURES of ISOPELARGONIC ACID:
-Extinguishing media:
*Suitable extinguishing media:
foam, dry chemical, carbon dioxide (CO2), water spray
*Precautions for firefighting:
Cool containers / tanks with water spray.
Dike and collect water used to fight fire.




EXPOSURE CONTROLS/PERSONAL PROTECTION of ISOPELARGONIC ACID:
-Personal protective equipment:
General industrial hygiene practice
Ensure that eyewash stations and safety showers are close to the workstation location.
*Hygiene measures:
When using, do not eat, drink or smoke.
Take off all contaminated clothing immediately.
Wash hands before breaks and immediately after handling the product.
*Hand protection:
Wear protective gloves.
Suitable material: nitrile rubber
Suitable material: polyvinylchloride
*Eye protection:
Safety glasses with side-shields.
*Skin and body protection:
Impervious clothing.
-Environmental exposure controls:
If possible use in closed systems.



HANDLING and STORAGE of ISOPELARGONIC ACID:
-Precautions for safe handling
*Advice on safe handling:
Wash hands before breaks and immediately after handling the product.
*Hygiene measures:
When using, do not eat, drink or smoke.
Take off all contaminated clothing immediately.
Wash hands before breaks and immediately after handling the product.



STABILITY and REACTIVITY of ISOPELARGONIC ACID:
-Chemical stability:
Stable under recommended storage conditions.
-Possibility of hazardous reactions:
Hazardous polymerisation does not occur.



SYNONYMS:
3,5,5-TRIMETHYLHEXANOIC ACID
7-methyloctanoic acid
ISONONANOIC ACID
693-19-6
26896-18-4
Octanoic acid, 7-methyl-
Isononanoicacid
7-methyl-octanoic acid
7-methyl caprylic acid
M3MIU88L6U
7-Methyloctanoicacid
Isononansaure
isononanic acid
iso-nonanoic acid
7-Methyloctansaeure
7-Methyl-octansaeure
7-methylcaprylic acid
UNII-M3MIU88L6U
SCHEMBL254102
CHEBI:37108
DTXSID10883129
ZINC2012819
LMFA01020003
AKOS006272652
AS-56712
CS-0265355
FT-0621464
FT-0655830
D93038
A836428
Q27117040
7-Methyl-octansaeure
Glyoxylamide,N-2-naphthyl-,oxime (7CI)
Acetamide,2-(hydroxyimino)-N-2-naphthalenyl
Isonitrosoacetyl-2-naphthylamin
ISONONANOIC ACID
isononanic acid
Glyoxylamide,N-2-naphthyl-,2-oxime (8CI)
(2Z)-2-HYDROXYIMINO-N-NAPHTHALEN-2-YL-ACETAMIDE
isononoic acid

ISOPENTANOL = ISOAMYL ALCOHOL

Isopentanol is a colorless liquid with a mild, choking alcohol odor.
Isopentanol is a colorless, clear liquid with the chemical formula (CH3)2CHCH2CH2OH and the CAS # 123-51-3.
The nontoxic compound has a mild, choking disagreeable odor.

CAS Number: 123-51-3
EC Number: 204-633-5
Chemical Formula: C5H12O
Molar Mass: 88.148 g/mol

Isopentanol is a colorless liquid with a mild, choking alcohol odor.
Less dense than water, soluble in water.

Hence floats on water.
Produces an irritating vapor.

Isopentanol is a natural product found in Aloe africana, Psidium guajava, and other organisms with data available.

Isoamylol is an primary alcohol that is butan-1-ol in which a hydrogen at position 3 has been replaced by a methyl group.
Isopentanol has a role as a xenobiotic metabolite, a Saccharomyces cerevisiae metabolite and an antifungal agent.

Isopentanol is a primary alcohol, a volatile organic compound and an alkyl alcohol.
Isopentanol derives from a hydride of an isopentane.

Isopentanol, also known as Isoamyl Alcohol is a clear, colorless, liquid organic compound that is one of several isomers of amyl alcohol.
Isopentanol is a principal ingredient in the production of banana oil, a natural ester used in the flavoring industry.
Isopentanol is also used as an antifoaming agent in the Chloroform: Isomyl Alcohol reagent.

Isopentanol is a colorless, clear liquid with the chemical formula (CH3)2CHCH2CH2OH and the CAS # 123-51-3.
The nontoxic compound has a mild, choking disagreeable odor.

Isopentanol is less dense than water, soluble in water, and floats on water.
Isopentanol main use in industry is as a food additive and flavoring agent.
Isopentanol is manufactured from light petroleum by fractional distillation.

Isopentanol is one of a range of next-generation biofuels that can be produced by advanced biochemical production routes (i.e., genetically engineered metabolic pathways).
Isopentanol is a C5 branched alcohol and is also called 3-methyl-1-butanol.

In comparison with the most frequently studied ethanol, the molecular structure of isopentanol has a longer carbon chain and includes a methyl branch.
The volumetric energy density of isopentanol is over 30% higher than ethanol. Therefore, isopentanol has the capability to be a better alternative than ethanol to gasoline.

A detailed chemical kinetic model for isopentanol has been developed focusing on autoignition characteristics over a wide range of temperatures.
The isopentanol model developed in this study includes high- and low-temperature chemistry.

In the isopentanol model, high temperature chemistry is based on a reaction model for butanol isomers whose reaction paths are quite similar to isopentanol.
The low-temperature chemistry is based on a reaction model for isooctane which is a branched molecular structure similar to isopentanol.

The model includes a new reaction mechanism for a concerted HO2 elimination, a process recently examined by da Silva et al. for ethanol.
In addition, important reaction mechanisms relevant to low temperature chemistry were considered in this model.

The authors conducted experiments with a shock-tube and a rapid compression machine to evaluate and improve accuracies of this model.
The experiments were carried out over a wide range of temperatures, pressures, and equivalence ratios (652−1457 K, 0.7−2.3 MPa, and 0.5−2.0, respectively).

Excellent agreement between model calculations and experimental data was achieved under most conditions.
Therefore, Isopentanol is believed that the isopentanol model developed in this study is useful for prediction and analysis of combustion performance involving autoignition processes such as a homogeneous charge compression ignition.

Isopentanol (3-methyl-1-butanol) is a fuel additive and a second-generation biofuel.
H-abstraction reactions from isopentanol by H atoms and CH3 radicals are the basic starting responses in the combustion reaction mechanism of isopentanol.

This work utilizes high quantum chemical theory and kinetic methods to describe the H-abstraction reaction from isopentanol by the H atom and CH3 radical, as well as the isomerization and β-dissociation of isopentanol radicals.
The potential energy surfaces (PESs) were calculated using the CCSD(T)/CBS//M06–2X-D3(0)/def2-TZVP method.

The second-order Møller-Plesset perturbation theory (MP2), combined with a coupled cluster method CCSD(T), fully exploited the consistency of the Dunning basis set, the set of cc-pVQZ, cc-pVTZ, and cc-pVDZ basis sets, which were used and extrapolated to the complete basis set (CBS) limit.
From the conventional transition state theory (CTST), the rate constants of the title reactions were calculated at temperatures ranging from 300 to 2000 K.

Compared with the H-abstraction reaction by CH3 radicals, the H-abstraction reaction by H atoms follows the Evans-Polanyi principle.
Isopentanol was found that the α-site was the most favorable H-abstraction site, while the O-site was relatively difficult.

In the reaction of isopentanol radicals, the isomerization reaction pathways usually dominate at low temperatures, especially the 1,4-H and 1,5-H shift isomerization reactions.
β-C-C bond dissociation dominates at high temperatures.
This study extends the kinetic data for the H-abstraction of isopentanol and subsequent β-dissociation and isomerization of isopentanol radicals over a wide range of pressures and temperatures.

Isopentanol is a colorless liquid with the formula C5H12O, specifically (H3C–)2CH–CH2–CH2–OH.
Isopentanol is one of several isomers of amyl alcohol (pentanol).

Isopentanol is also known as isopentyl alcohol, isopentanol, or (in the IUPAC recommended nomenclature) 3-methyl-butan-1-ol.
An obsolete name for Isopentanol was isobutyl carbinol.

Isopentanol is an ingredient in the production of banana oil, an ester found in nature and also produced as a flavouring in industry.
Isopentanol is a common fusel alcohol, produced as a major by-product of ethanol fermentation.

Uses of Isopentanol:
Besides Isopentanol use in the synthesis of banana oil, Isopentanol is also an ingredient of Kovac's reagent, used for the bacterial diagnostic indole test.
Isopentanol is also used as an antifoaming agent in the chloroform Isopentanol reagent.
Isopentanol is used in a phenol–chloroform extraction mixed with the chloroform to further inhibit RNase activity and prevent solubility of RNAs with long tracts of poly-adenine.

Isopentanol is used as a solvent, paint stripper, and intermediate in the photographic and pharmaceutical industries.
Isopentanol is used in soft drinks, alcoholic beverages, ice cream, ices, etc., confectionery, bakery products, gelatins and puddings, chewing gum.

Extraction from fusel oil:
Isopentanol can be separated from fusel oil by either of two methods: shaking with strong brine solution and separating the oily layer from the brine layer; distilling Isopentanol and collecting the fraction that boils between 125 and 140 °C.
Further purification is possible with this procedure: shaking the product with hot limewater, separating the oily layer, drying the product with calcium chloride, and distilling Isopentanol, collecting the fraction boiling between 128 and 132 °C.

Occurrence of Isopentanol:
Isopentanol is one of the components of the aroma of Tuber melanosporum, the black truffle.
The compound has also been identified as a chemical in the pheromone used by hornets to attract other members of the hive to attack.
Isoamyl acetate is a component of the natural aroma of bananas, especially the Gros Michel variety.

Synthesis of Isopentanol:
Isopentanol can be synthesized by condensation of isobutene and formaldehyde which produces isoprenol and hydrogenation.
Isopentanol is a colourless liquid of density 0.8247 g/cm3 (0 °C), boiling at 131.6 °C, slightly soluble in water, and easily dissolved in organic solvents.

Isopentanol has a characteristic strong smell and a sharp burning taste.
On passing the vapour through a red-hot tube, Isopentanol decomposes into acetylene, ethylene, propylene, and other compounds.
Isopentanol is oxidized by chromic acid to isovaleraldehyde, and Isopentanol forms addition compounds crystals with calcium chloride and tin(IV) chloride.

Production Methods of Isopentanol:
Isopentanol is produced from isobutylene through the oxo process.

Isopentanol is produced from light petroleum by fractional distillation by dehydration of the pentane fraction, which is then heated and refractionated, and the amylchloride fraction, which is fractionally distilled again to yield a mono-chloro-pentane mixture.
Isopentanol is hydrolyzed with sodium oleate solution in the presence of catalyst.

Isopentanol is produced by fractionation of fusel oil and chlorination of pentanes.

Handling and Storage of Isopentanol:

Nonfire Spill Response:
ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.
All equipment used when handling the product must be grounded.

Do not touch or walk through spilled material.
Stop leak if you can do Isopentanol without risk.

Prevent entry into waterways, sewers, basements or confined areas.
A vapor-suppressing foam may be used to reduce vapors.

Absorb or cover with dry earth, sand or other non-combustible material and transfer to containers.
Use clean, non-sparking tools to collect absorbed material.

LARGE SPILL:
Dike far ahead of liquid spill for later disposal. Water spray may reduce vapor, but may not prevent ignition in closed spaces.

Safe Storage:
Fireproof.
Separated from strong oxidants and reducing agents.

Storage Conditions:
In general, materials which are toxic as stored or which can decomp into toxic components should be stored in a cool, well-ventilated place, out of direct rays of the sun, away from areas of high fire hazard, & should be periodically inspected incompatible materials should be isolated from each other.

First Aid Measures of Isopentanol:

Eye:
IRRIGATE IMMEDIATELY - If this chemical contacts the eyes, immediately wash (irrigate) the eyes with large amounts of water, occasionally lifting the lower and upper lids.
Get medical attention immediately.

Skin:
WATER FLUSH PROMPTLY - If this chemical contacts the skin, flush the contaminated skin with water promptly.
If this chemical penetrates the clothing, immediately remove the clothing and flush the skin with water promptly.
If irritation persists after washing, get medical attention.

Breathing:
RESPIRATORY SUPPORT - If a person breathes large amounts of this chemical, move the exposed person to fresh air at once.
If breathing has stopped, perform artificial respiration.
Keep the affected person warm and at rest. Get medical attention as soon as possible.

Swallow:
MEDICAL ATTENTION IMMEDIATELY - If this chemical has been swallowed, get medical attention immediately.

Fire Fighting of Isopentanol:

Fire Extinguishing Agents:
Use water spray, alcohol-resistant foam, powder, carbon dioxide.

In case of fire:
Keep drums, etc., cool by spraying with water.

Fire Fighting Procedures of Isopentanol:
Use water, powder, "alcohol" foam or carbon tetrachloride.
Water spray is effective for cooling fire-exposed containers, dispersing spills before burning, and protection from heat those persons engaged to stop leakage during the fire.

If material on fire or involved in fire:
Do not extinguish fire unless flow can be stopped.
Use water in flooding quantities as fog.

Solid streams of water may be ineffective.
Cool all affected containers with flooding quantities of water.

Apply water from as far a distance as possible.
Use "alcohol" foam, carbon dioxide or dry chemical.

Identifiers of Isopentanol:
CAS Number: 123-51-3
ChEBI: CHEBI:15837
ChEMBL: ChEMBL372396
ChemSpider: 29000
DrugBank: DB02296
ECHA InfoCard: 100.004.213
KEGG: C07328
PubChem CID: 31260
UNII: DEM9NIT1J4
CompTox Dashboard (EPA): DTXSID3025469
InChI:
InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3
Key: PHTQWCKDNZKARW-UHFFFAOYSA-N
InChI=1/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3
Key: PHTQWCKDNZKARW-UHFFFAOYAW
SMILE: SOCCC(C)C

CAS: 123-51-3
EINECS: 204-633-5
InChI: InChI=1/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3

Synonyms: Isoamyl alcohol, Isopentyl alcohol, 3-Methyl-1-butanol
Linear Formula: (CH3)2CHCH2CH2OH
CAS Number: 123-51-3
Molecular Weight: 88.15

Properties of Isopentanol:
Chemical formula: C5H12O
Molar mass: 88.148 g/mol
Appearance: Clear, colorless liquid
Odor: Disagreeable odor in high concentrations
Density: 0.8104 g/cm3 at 20 °C
Melting point: −117[2][3] °C (−179 °F; 156 K)
Boiling point: 131.1 °C (268.0 °F; 404.2 K)
Solubility in water: Slightly soluble, 28 g/L
Solubility: Very soluble in acetone, diethyl ether, ethanol
Vapor pressure: 28 mmHg (20 °C)[3]
Magnetic susceptibility (χ): −68.96·10−6 cm3/mol
Viscosity: 3.692 mPa·s

Molecular Formula: C5H12O
Molar Mass: 88.15
Density: 0.809g/mLat 25°C(lit.)
Melting Point: -117 °C
Boling Point: 131-132°C
Flash Point: 109.4°F
JECFA Number: 52
Water Solubility: 25 g/L (20 ºC)
Solubility: 25g/l
Vapor Presure: 2 mm Hg ( 20 °C)
Vapor Density: 3 (vs air)
Appearance: Liquid
Specific Gravity: 0.813 (15/4℃)
Color: <20(APHA)
Odor: Mild odor; alcoholic, non-residual.
Exposure Limit: NIOSH REL: TWA 100 ppm (360 mg/m3), IDLH 500 ppm; OSHA PEL: TWA100 ppm; ACGIH TLV: TWA 100 ppm, STEL 125 ppm (adopted).
Maximum wavelength(λmax): ['λ: 260 nm Amax: 0.06',
, 'λ: 280 nm Amax: 0.06']
Merck: 14,5195
BRN: 1718835
pKa: >14 (Schwarzenbach et al., 1993)
PH: 7 (25g/l, H2O, 20℃)
Storage Condition: room temp
Stability: Stable. Flammable. Incompatible with strong oxidizing agents, strong acids, acid chlorides, acid anhydrides.
Explosive Limit: 1.2-9%, 100°F
Refractive Index: n20/D 1.407

Molecular Weight: 88.15
XLogP3: 1.2
Hydrogen Bond Donor Count: 1
Hydrogen Bond Acceptor Count: 1
Rotatable Bond Count: 2
Exact Mass: 88.088815002
Monoisotopic Mass: 88.088815002
Topological Polar Surface Area: 20.2 Ų
Heavy Atom Count: 6
Complexity: 25.1
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes

Specifications of Isopentanol:
Formula: C5H12O
CAS no.: 137-32-6
Gas Response Factor, 11.7 eV: 0.8
Gas Response Factor, 10.6 eV: 2
Gas Response Factor, 10.0 eV: 6
ppm per mg/m⁻³, (20 °C, 1 bar): 0.273
Molecular Weight, g/mole: 88.2
Specification: Value/Information
Melting point, °C: -70
Boiling point, °C: 129
Flash point, °C: 40
Upper Explosive Limit, %: 10.5
Lower Explosive Limit, %: 1.2
Density, g.cm⁻³: 0.82
Ionisation Energy, eV: 9.86

Thermochemistry of Isopentanol:
Heat capacity (C): 2.382 J/g·K
Std enthalpy of formation (ΔfH⦵298):
−356.4 kJ/mol (liquid)
−300.7 kJ/mol (gas)

Related Products of Isopentanol:
3,3-Dimethylbutyric Acid
3,3-Dimethylbutanoic Acid-d9
3-(N,N-Diethylaminocarbonyl)phenylboronic acid
4-(N,N-Diethylaminocarbonyl)phenylboronic acid
3-(N,N-Diethylaminocarbonyl)phenylboronic acid, pinacol ester
Nivalenol
(R)-Ochratoxin α
Di-N-heptytin Dichloride-D30
p-Coumaric Acid 4-O-Sulfate Disodium Salt
Ergosinine

Names of Isopentanol:

Preferred IUPAC name:
3-Methylbutan-1-ol

Other names:
3-Methyl-1-butanol
Isopentyl alcohol
Isopentanol
Isobutylcarbinol

Synonyms of Isopentanol:
Isoamyl alcohol
3-Methyl-1-butanol
Isopentyl alcohol
3-Methylbutan-1-ol
123-51-3
Isopentanol
3-Methylbutanol
1-Butanol, 3-methyl-
Isoamylol
Isobutylcarbinol
2-Methyl-4-butanol
Iso-amylalkohol
Iso-amyl alcohol
Isobutyl carbinol
ISOAMYLALCOHOL
Alcool isoamylique
Fermentation amyl alcohol
Alcool amilico
Amylowy alkohol
Isoamyl alkohol
i-Amyl Alcohol
Primary isoamyl alcohol
3-Metil-butanolo
isopentan-1-ol
Isoamyl alcohol (natural)
MFCD00002934
FEMA No. 2057
isoamyl-alcohol
3-Methyl-Butan-1-Ol
Isoamyl alcohol, primary
3-methyl-Butanol
NSC 1029
Methyl-3-butan-1-ol
Butan-1-ol, 3-methyl
DEM9NIT1J4
Fuseloel
Huile de fusel
CHEBI:15837
3-METHYL-BUTAN-(1)-OL
NSC-1029
NSC-7905
iso-pentanol
WLN: Q2Y1 & 1
FEMA Number 2057
Isoamyl alkohol [Czech]
Alcool amilico [Italian]
Amylowy alkohol [Polish]
Iso-amylalkohol [German]
1-Hydroxy-3-Methylbutane
Alcool isoamylique [French]
3-Metil-butanolo [Italian]
HSDB 605
3-methylbutyl alcohol
EINECS 204-633-5
UNII-DEM9NIT1J4
iso-amylalcohol
isopentylalcohol
Isopentylalkohol
AI3-15288
CCRIS 8806
3-methylbutanoI
3-methyl butanol
3-methyl 1-butanol
3-methyl-1 butanol
3-methylbutane-1-ol
Butanol, 3-methyl-
Isoamyl alcohol (primary and secondary)
6423-06-9
EC 204-633-5
3-Methyl-1-butanol, 98%
ISOAMYL ALCOHOL [FCC]
ISOAMYL ALCOHOL [FHFI]
ISOAMYL ALCOHOL [HSDB]
ISOAMYL ALCOHOL [INCI]
ISOPENTYL ALCOHOL [MI]
CHEMBL372396
QSPL 002
DTXSID3025469
Isoamyl alcohol, >=98%, FG
NSC1029
NSC7905
ZINC896830
Isoamyl alcohol (3-methyl butanol)
3-Methylbutanol, analytical standard
EINECS 229-179-5
Tox21_302359
LMFA05000108
STL282718
3-Methyl-1-butanol A.C.S. Reagent
3-Methyl-1-butanol, LR, >=98%
AKOS000118739
Magnesium bis(3-methylbutan-1-olate)
NATURAL ISOAMYL ALCOHOL P & F
3-METHYL-1-BUTANOL [USP-RS]
DB02296
3-Methyl-1-butanol, p.a., 99.8%
Isoamyl alcohol, natural, >=98%, FG
3-Methyl-1-butanol, analytical standard
NCGC00255329-01
3-Methyl-1-butanol, anhydrous, >=99%
CAS-123-51-3
3-Methyl-1-butanol, reagent grade, 98%
3-Methyl-1-butanol, technical grade, 95%
ISOAMYL ALCOHOL ULTRA PURE GRADE 1L
FT-0616032
I0289
EN300-19333
3-Methyl-1-butanol, ACS reagent, >=98.5%
3-Methyl-1-butanol, biotech. grade, >=99%
3-Methyl-1-butanol, ReagentPlus(R), >=99%
C07328
NATURAL ISOAMYL ALCOHOL - TECHNICAL GRADE
3-Methyl-1-butanol, SAJ first grade, >=96.0%
Q223101
3-Methyl-1-butanol, JIS special grade, >=98.0%
F0001-0367
Z104473558
3-Methylbutanol, BioReagent, for molecular biology, >=98.5%
3-Methylbutanol, puriss. p.a., ACS reagent, >=98.5% (GC)
3-Methylbutanol, BioUltra, for molecular biology, >=99.0% (GC)
3-Methyl-1-butanol, United States Pharmacopeia (USP) Reference Standard
3-Methylbutanol, p.a., ACS reagent, reag. ISO, reag. Ph. Eur., 98.5%
Isopentanol
alcoolamilico
3-methylbutan-
Alcool amilico
Isoamyl Alconol
Isoamyl Alcohol
3-methylbutanol
3-methylbutanoI
3-Methyl Butanol
3-Metil-butanolo
Isopentyl Alcohol
3-methyl-1-butano
alcoolisoamylique
3-Methyl-1-butanol
2-methylbutan-1-ol
Alcool isoamylique
3-methylbutan-1-ol
3-Methyl-1-Butanol
Natural Isoamyl Alcohol
Natural 3-Methylbutanol
2,2-dimethylbutanoic acid
(1s-Exo, Exo-3-(N-(3,5-Dimethylphenyl)Benzenesulfonamide)Iso-Borneol

MeSH Entry Terms of Isopentanol:
3-methyl-1-butanol
isoamyl alcohol
isopentanol
isopentyl alcohol
isopentyl alcohol, 1-(14)C-labeled
isopentyl alcohol, barium salt
isopentyl alcohol, lead (2+) salt
isopentyl alcohol, magnesium salt
isopentyl alcohol, potassium salt
isopentyl alcohol, sodium salt
isopentyl alcohol, strontium salt

ISOPHORONE; 1,1,3-Trimethyl-3-cyclohexene-5-one; Alpha-isophorone; 3,5,5-Trimethylcyclohex-2-enone; Isoforone (Italian); 3,5,5-Trimethyl-2-Cyclohexenone; 3,5,5-Trimethylcyclohexenone; Isoforon; Isoacetophorone; 3,5,5-Trimethyl-2-cyclohexen-1-one; Izoforon (Polish); 3,5,5-Trimethyl-2-cyclohexen-1-on (German); 1,5,5-Trimethyl-1-cyclohexen-3-one; Isooctopherone; cas no: 78-59-1

5-Amino-1,3,3-Trimethyl Cyclohexanemethanamine; 1-Amino-3-aminomethyl-3,5,5-trimethyl cyclohexane; 3-Aminomethyl-3,5,5-trimethyl cyclohexylamine; 3-Aminomethyl-3,5,5-trimethylcyclohexylamin (German); 3-Aminometil-3,5,5-trimetilciclohexilamina (Spanish); 3-Aminométhyl-3,5,5-triméthyl cyclohexylamine (French) cas no: 2855-13-2

Isophorone is used in industries to help dissolve other chemicals such as printing inks, paints, lacquers, and adhesives.
Isophorone is used as solvent for vinyl chloride-acetate based coatings, solvent for nitrocellulose lacquers, solvent for printing inks, and solvent for lacquer thinners.
Isophorone is exhibits slight solubility in water but good miscibility with most lacquer solvents.

CAS Number: 78-59-1
EC Number: 201-126-0
Chemical Formula: C9H14O
Molar Mass: 138.21 g/mol

Isophorone is an α,β-unsaturated cyclic ketone.
Isophorone is a colorless liquid with a characteristic peppermint-like odor, although commercial samples can appear yellowish.
Isophorone is used as a solvent and as a precursor to polymers, Isophorone is produced on a large scale industrially.

Isophorone is a clear liquid that smells like peppermint.
Isophorone can be dissolved in water.

Isophorone is used in industries to help dissolve other chemicals such as printing inks, paints, lacquers, and adhesives.
Isophorone can also be used as an intermediate to make other chemicals.

Although isophorone is an industrial chemical, Isophorone also occurs naturally in cranberries.
Isophorone is acts as a stable, colorless, high-boiling, low vapor pressure solvent.

Isophorone is used as solvent for vinyl chloride-acetate based coatings, solvent for nitrocellulose lacquers, solvent for printing inks, and solvent for lacquer thinners.
Isophorone is exhibits slight solubility in water but good miscibility with most lacquer solvents.
Isophorone is possesses high solvency power, and high dilution ratio for aromatic hydrocarbons.

Isophorone is a clear liquid that smells like peppermint.
Isophorone can be dissolved in water and evaporates somewhat faster than water.

Isophorone is an industrial chemical used as a solvent in some printing inks, paints, lacquers, and adhesives.
Isophorone is also used as an intermediate in the production of certain chemicals.

Although isophorone is an industrial chemical, Isophorone also occurs naturally in cranberries.
Agency for Toxic Substances and Disease Registry (ATSDR)
Isophorone appears as a clear colorless liquid, with a camphor-like odor.

Isophorone is less dense than water and insoluble in water.
Isophorone is boiling point 420 °F.

Isophorone is flash point near 200 °F.
Isophorone is contact irritates skin and eyes.
Isophorone is toxic by ingestion.

Isophorone is used as a solvent and in pesticides.

Isophorone is a cyclic ketone, the structure of which is that of cyclohex-2-en-1-one substituted by methyl groups at positions 3, 5 and 5.
Isophorone has a role as a solvent and a plant metabolite.
Isophorone is a cyclic ketone and an enone.

Isophorone is a widely used solvent and chemical intermediate. The acute (short-term) effects of isophorone in humans from inhalation exposure include eye, nose, and throat irritation.
Chronic (long- term) exposure to isophorone in humans can cause dizziness, fatigue, and depression.

Animal studies indicate that long-term inhalation of high concentrations of isophorone causes central nervous system effects.
Limited evidence in animal studies suggests that isophorone may cause birth defects such as fetal malformations and growth retardation from inhalation exposure to isophorone during pregnancy.

No information is available on the reproductive, developmental, or carcinogenic effects of isophorone in humans.
EPA has classified isophorone as a Group C, possible human carcinogen.

Uses of Isophorone:
Isophorone is used mainly as a solvent for concentrated vinyl chloride/acetate-based coating systems for metal cans, other metal paints, nitrocellulose finishes, and printing inks for plastics.
Isophorone is also used in some herbicide and pesticide formulations and in adhesives for plastics, polyvinylchloride, and polystyrene materials.
Isophorone is an intermediate in the synthesis of 3,5-xylenol, 3,3,5-trimethylcyclohexanol, and plant growth retardants.

Isophorone is used as a solvent for coatings, especially vinyl resins applied by roller.
Also used as a chemical intermediate and a solvent for other materials.

Not registered for current use in the U.S., but approved pesticide uses may change periodically and so federal, state and local authorities must be consulted for currently approved uses.

Solvent for lacquers & plastics.
Solvent for many oils, fats, gums, resins, nitrocellulose, & vinyl-resin copolymers.
Chem int for 3,3,5-trimethylcyclohexanol, & 3,5-xylenol; specialty solvent.

Industry Uses:
Intermediates
Solvents (which become part of product formulation or mixture)
Waste

Consumer Uses of Isophorone:
Paints and coatings

Use Classification of Isophorone:
Hazardous Air Pollutants (HAPs)

Food additives:
Flavoring Agents

Flavoring Agents:
JECFA Flavorings Index

Flavouring Agent:
FLAVOURING_AGENT - JECFA Functional Classes

Applications of Isophorone:
The partly hydrogenated derivative trimethylcyclohexanone is used in production of polycarbonates.
Isophorone condenses with phenol to give an analogue of bisphenol A.

Polycarbonates produced by phosgenation of these two diols produces a polymer with improved thermal stability.
Trimethyladipic acid and 2,2,4-trimethylhexamethylenediamine are produced from trimethylcyclohexanone and trimethylcyclohexanol.

They are used to make specialty polyamides.
Hydrocyanation gives the nitrile followed by reductive amination gives isophorone diamine.
This diamine is used to produce isophorone diisocyanate which has certain niche applications.

Full hydrogenation gives 3,3,5-Trimethylcyclohexanol, a precursor to both sunscreens and chemical weapons.

Structure and reactivity of Isophorone:
Isophorone undergoes reactions characteristic of an α,β-unsaturated ketone.
Hydrogenation gives the cyclohexanone derivative.

Epoxidation with basic hydrogen peroxide affords the oxide.
Isophorone is degraded by attack of hydroxyl radicals.

Photodimerization of Isophorone:
When exposed to sunlight in aqueous solutions, isophorone undergoes 2+2 photocycloaddition to give three isomeric photodimers.
These "diketomers" are cis-syn-cis, head to tail (HT), cys-anti-cys (HT), and head-head (HH).
The formation of HH photodimers is favored over HT photodimers with increasing polarity of the medium.

Natural Occurrence of Isophorone:
Isophorone occurs naturally in cranberries.

Synthesis of Isophorone:
Isophorone is produced on a multi-thousand ton scale by the aldol condensation of acetone using KOH.
Diacetone alcohol, mesityl oxide, and 3-hydroxy-3,5,5-trimethylcyclohexan-1-one are intermediates.
A side product is beta-isophorone, where the C=C group is not conjugated with the ketone.

Human Metabolite Information of Isophorone:

Cellular Locations of Isophorone:
Cytoplasm
Extracellular

Methods of Manufacturing of Isophorone:
Acetone is passed over calcium oxide, hydroxide or carbide or their mixt at 350 °c and atmospheric pressure, or Isophorone is heated 200-250 °c under pressure.
Isophorone is separated from resultant products by distillation.

Produced by the condensation of acetone in the liquid phase at ca. 200 °C and 3.6 Mpa in the presence of an aqueous potassium hydroxide solution (ca. 1%).
The process steps condensation, separation of unreacted acetone, and hydrolysis of by products can be carried out in a single reactor.
Reaction in the gas phase at 350 °C over calcium-aluminum oxide has also been reported.

General Manufacturing Information of Isophorone:

Industry Processing Sectors of Isophorone:
Paint and coating manufacturing
Pesticide, fertilizer, and other agricultural chemical manufacturing
Printing ink manufacturing

Analytic Laboratory Methods of Isophorone:

NIOSH Method: 2508
Technique: Gas chromatography, FID.

The working range for this method is 0.35 to 70 ppm (2 to 400 mg/cu m) for a 12-L air sample.

Estimated limit of detection: 0.02 mg per sample.

Isophorone has been determined in water by gas chromatography and mass spectrometry.

EPA Method 609-A.
Nitroaromatics and Isophorone in Wastewater by Gas Chromatography with Electron Capture Detection.
Detection limit = 16.000 ug/l.

EPA Method 609-B.
Nitroaromatics and Isophorone in Wastewater by Gas Chromatography with Flame Ionization Detection.
Detection limit = 5.7 ug/l.

Sources and Potential Exposure of Isophorone:
Major sources of airborne isophorone are the printing and the metal coating industries.
Coal-fired power plants may also emit isophorone to the air.

Individuals may be exposed to isophorone through breathing contaminated air, especially people who work with inks, paints, lacquers, and adhesives.
Isophorone has been detected in the drinking water of several cities at very low concentrations.

Assessing Personal Exposure of Isophorone:
No medical tests are currently available to determine human exposure to isophorone.

Physical Properties of Isophorone:
Isophorone is a water-white colored liquid with a peppermint-like odor.
The chemical formula for isophorone is C9H14O and the molecular weight is 138.21 g/mol.

The vapor pressure for isophorone is 0.3 mm Hg at 20 °C and Isophorone has an octanol/water partition coefficient (log Kow) of 1.67.
Isophorone has an odor threshold of 0.20 parts per million (ppm).
Isophorone is slightly soluble in water.

History of Isophorone:
The use of isophorone as a solvent resulted from the search for ways to dispose of or recycle acetone, which is a waste product of phenol synthesis by the Hock method.

Production of the solvent isophorone started in 1962 in the Herne nitrogen works of Hibernia AG.
The development of the new solvent resulted from the search for ways in which to dispose of or recycle acetone.
In 1967 Isophorone production was carried out in what is today the Herne plant of Evonik Industries AG and was previously the Hibernia factory Herne I.

Putting the first production plant into operation in 1967 signaled the start of acetone chemistry in Herne that was intended to position the site for the future and that still provides Isophorone with security today.
When VEBA AG reorganized Isophorone chemical business, the Herne plants were transferred to Hüls AG in 1979 and so was the Isophorone product family.
Since 1992 product variants of Isophorone and since 1999 Isophorone are today also manufactured at the Evonik site in Mobile, Alabama.

Isophorone has excellent solvent properties for binders, resins, and numerous chemical products.
Isophorone is used as high boiling solvent in paints, printing inks and adhesives.

In these applications Isophorone improves flowing properties and brightness.
Because of Isophorone special chemical structure, Isophorone serves as starting material for production of several chemicals, which otherwise are hardly producible.

These Isophorone derivatives are used in many different areas.
In the construction industry, for example, they are used as corrosion protection on bridges, scaffolding or sluices.
They are used in wood preservatives and to seal floors.

Safety of Isophorone:
The LD50 value of isophorone in rats and rabbits by oral exposure is around the 2.00 g/kg.
The safety aspects of isophorone have been subject to several studies.

First Aid of Isophorone:

EYES:
First check the victim for contact lenses and remove if present.
Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center.

Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician.
IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

SKIN:
IMMEDIATELY flood affected skin with water while removing and isolating all contaminated clothing.
Gently wash all affected skin areas thoroughly with soap and water.
If symptoms such as redness or irritation develop, IMMEDIATELY call a physician and be prepared to transport the victim to a hospital for treatment.

INHALATION:
IMMEDIATELY leave the contaminated area; take deep breaths of fresh air.
If symptoms (such as wheezing, coughing, shortness of breath, or burning in the mouth, throat, or chest) develop, call a physician and be prepared to transport the victim to a hospital.

Provide proper respiratory protection to rescuers entering an unknown atmosphere.
Whenever possible, Self-Contained Breathing Apparatus (SCBA) should be used; if not available, use a level of protection greater than or equal to that advised under Protective Clothing.

INGESTION:
DO NOT INDUCE VOMITING.
If the victim is conscious and not convulsing, give 1 or 2 glasses of water to dilute the chemical and IMMEDIATELY call a hospital or poison control center.

Be prepared to transport the victim to a hospital if advised by a physician.
If the victim is convulsing or unconscious, do not give anything by mouth, ensure that the victim's airway is open and lay the victim on his/her side with the head lower than the body.

DO NOT INDUCE VOMITING.
IMMEDIATELY transport the victim to a hospital.

Fire Fighting of Isophorone:
Use water spray, powder, foam, carbon dioxide.

Fire Fighting Procedures of Isophorone:
Do not extinguish fire unless flow can be stopped.
Use water in flooding quantities as fog.

Solid streams of water may be ineffective.
Cool all affected containers with flooding quantities of water.

Apply water from as far a distance as possible.
Use "alcohol" foam, dry chemical or carbon dioxide.

If material on fire or involved in fire:
Do not extinguish fire unless flow can be stopped or safely confined.
Use water in flooding quantities as fog.

Solid streams of water may be ineffective.
Cool all affected containers with flooding quantities of water.

Apply water from as far a distance as possible.
Use "alcohol" foam, dry chemical or carbon dioxide.

Use water spray to keep fire exposed containers cool.
Use flooding quantities of water as fog or spray, dry chemical, foam, or carbon dioxide.

Spillage Disposal of Isophorone:

Personal protection:
Filter respirator for organic gases and vapours adapted to the airborne concentration of Isophorone.
Collect leaking and spilled liquid in sealable containers as far as possible.

Absorb remaining liquid in sand or inert absorbent.
Then store and dispose of according to local regulations.

Cleanup Methods of Isophorone:
If leak or spill has not ignited, use water spray to disperse vapors & to protect men attempting to stop leak.

Environmental considerations:

Land spill:
Dig a pit, pond, lagoon, holding area to contain liquid or solid material.
If time permits, pits, ponds, lagoons, soak holes, or holding areas should be sealed with an impermeable flexible membrane liner.

Dike surfact flow using soil, sand bags, foamed polyurethane, or foamed concrete.
Absorb bulk liquid with fly ash, cement powder, or comercial sorbents.

Environmental considerations:

Water spill:
Use natural barriers or oil spill control booms to limit spill travel.
Remove trapped material with suction hoses.

Environmental considerations:

Air spill:
Apply water spray or mist ot knock kown vapors.

Disposal Methods of Isophorone:
At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision.
Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

The following wastewater treatment technologies have been investigated for Isophorone.
Concentration process: Biological treatment.

The following wastewater treatment technologies have been investigated for Isophorone.
Concentration process: Solvent extraction.

The following wastewater treatment technologies have been investigated for Isophorone.
Concentration process: Activated carbon.

Spray into incinerator or burn in paper packaging.
Additional flammable solvent may be added.

Preventive Measures of Isophorone:
Irrigate eyes with water.
Wash skin with abundant quantities of water.

The scientific literature for the use of contact lenses in industry is conflicting.
The benefit or detrimental effects of wearing contact lenses depend not only upon Isophorone, but also on factors including the form of Isophorone, characteristics and duration of the exposure, the uses of other eye protection equipment, and the hygiene of the lenses.

However, there may be individual substances whose irritating or corrosive properties are such that the wearing of contact lenses would be harmful to the eye.
In those specific cases, contact lenses should not be worn.

In any event, the usual eye protection equipment should be worn even when contact lenses are in place.
Contaminated protective clothing should be segregated in such a manner so that there is no direct personal contact by personnel who handle, dispose, or clean the clothing.

Quality assurance to ascertain the completeness of the cleaning procedures should be implemented before the decontaminated protective clothing is returned for reuse by the workers.
Contaminated clothing should not be taken home at end of shift, but should remain at employee's place of work for cleaning.

Personnel protection:
Avoid breathing vapors.
Keep upwind.

Do not handle broken packages unless wearing appropriate personal protective equipment.
Wash away any material which may have contacted the body with copious amounts of water or soap and water.

Reactivity Profile of Isophorone:
Ketones, such as ISOPHORONE, are reactive with many acids and bases liberating heat and flammable gases (e.g., H2).
The amount of heat may be sufficient to start a fire in the unreacted portion of the ketone.

Ketones react with reducing agents such as hydrides, alkali metals, and nitrides to produce flammable gas (H2) and heat.
Ketones are incompatible with isocyanates, aldehydes, cyanides, peroxides, and anhydrides.

They react violently with aldehydes, HNO3, HNO3 + H2O2, and HClO4.
Forms explosive peroxides.

Handling and Storage of Isophorone:

Safe Storage of Isophorone:
Separated from strong oxidants, strong bases and amines.

Storage Conditions of Isophorone:
Store in a cool, dry, well-ventilated location.
Outside or detached storage is preferred.
Separate from oxidizing materials.

Identifiers of Isophorone:
CAS Number: 78-59-1
ChemSpider: 6296
ECHA InfoCard: 100.001.024
EC Number: 201-126-0
KEGG: C14743
PubChem CID: 6544
UNII: 2BR99VR6WA
CompTox Dashboard (EPA): DTXSID8020759
InChI: InChI=1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3
Key: HJOVHMDZYOCNQW-UHFFFAOYSA-N
InChI=1/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3
Key: HJOVHMDZYOCNQW-UHFFFAOYAC
SMILES: O=C1\C=C(/CC(C)(C)C1)C

CAS number: 78-59-1
EC index number: 606-012-00-8
EC number: 201-126-0
Hill Formula: C₉H₁₄O
Molar Mass: 138.21 g/mol
HS Code: 2914 29 00

Synonym(s): 3,5,5-Trimethyl-2-cyclohexen-1-one
Empirical Formula (Hill Notation): C9H14O
CAS Number: 78-59-1
Molecular Weight: 138.21
Beilstein: 1280721
EC Number: 201-126-0
MDL number: MFCD00001584
PubChem Substance ID: 24895951
NACRES: NA.22

Properties of Isophorone:
Chemical formula: C9H14O
Molar mass: 138.210 g·mol−1
Appearance: Colorless to white liquid
Odor: Peppermint-like
Density: 0.9255 g/cm3
Melting point: −8.1 °C (17.4 °F; 265.0 K)
Boiling point: 215.32 °C (419.58 °F; 488.47 K)
Solubility in water: 1.2 g/100 mL
Solubility: ether, acetone, hexane, dichloromethane, benzene, toluene, alcohol
Vapor pressure: 0.3 mmHg (20°C)
Refractive index (nD): 1.4766
Viscosity: 2.62 cP

Boiling point: 210 - 216 °C (1013 hPa)
Density: 0.92 g/cm3
Explosion limit: 0.8 - 3.8 %(V)
Flash point: 96.0 °C
Ignition temperature: 460 °C
Melting Point: -8.0 °C
Vapor pressure: 1.3 hPa (38.0 °C)
Solubility: 14.5 g/l

Vapor density: 4.77 (vs air)
Quality Level: 200
Vapor pressure: 0.2 mmHg ( 20 °C)
Assay: 97%
Form:Öliquid
Autoignition temp.: 864 °F
Expl. lim.: 3.8 %
Refractive index: n20/D 1.476 (lit.)
bp: 213-214 °C (lit.)
mp: −8 °C (lit.)
Density: 0.923 g/mL at 25 °C (lit.)
SMILES string: CC1=CC(=O)CC(C)(C)C1
InChI: 1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3
InChI key: HJOVHMDZYOCNQW-UHFFFAOYSA-N

Molecular Weight: 138.21
XLogP3-AA: 1.6
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 1
Rotatable Bond Count: 0
Exact Mass: 138.104465066
Monoisotopic Mass: 138.104465066:
Topological Polar Surface Area: 17.1 Ų
Heavy Atom Count: : 10:
Complexity: 187
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes

Quality Level: 200
Vapor density: 4.77 (vs air)
Vapor pressure: 0.2 mmHg ( 20 °C)
Assay: 97%
Form: liquid
Autoignition temp.: 864 °F
Expl. lim.: 3.8 %
Refractive index: n20/D 1.476 (lit.)
bp: 213-214 °C (lit.)
mp: −8 °C (lit.)
Density: 0.923 g/mL at 25 °C (lit.)
SMILES string: CC1=CC(=O)CC(C)(C)C1
InChI: 1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3
InChI key: HJOVHMDZYOCNQW-UHFFFAOYSA-N

Specifications of Isophorone:
Assay (GC, area%): ≥ 98.0 % (a/a)
Density (d 20 °C/ 4 °C): 0.920 - 0.922
Identity (IR): passes test
Color (visual): colorless to yellowish

Thermochemistry of Isophorone:
Std enthalpy of formation (ΔfH⦵298): 43.4 kJ/mol

Names of Isophorone:

Alternate Chemical Names:
ALPHA-ISOPHORON
ALPHA-ISOPHORONE
CYCLOHEXANE-1-ONE
ISOACETOPHORONE
ISOFORON
ISOPHORON
ISOPHORONE
NCI-C55618
3,5,5-TRIMETHYL-2-
3,5,5-TRIMETHYL-2-CYCLO-HEXEN-1-ONE
3,5,5-TRIMETHYL-2-CYCLOHEXENE-1-ONE
3,5,5-TRIMETHYL-2-CYCLOHEXENONE
1,1,3-TRIMETHYL-3-CYCLOHEXENE-5-ONE
1,5,5-TRIMETHYL-3-OXOCYCLOHEXENE
3,5,5-TRIMETHYL-5-CYCLOHEXEN-1-ONE

Preferred IUPAC name:
3,5,5-Trimethylcyclohex-2-en-1-one

Other names:
3,5,5-Trimethyl-2-cyclohexene-1-one
1,1,3-Trimethyl-3-cyclohexene-5-one
Isoforone
Isoacetophorone
IP

Synonyms of Isophorone:
ISOPHORONE
78-59-1
Isoacetophorone
3,5,5-Trimethylcyclohex-2-en-1-one
Isoforone
3,5,5-Trimethylcyclohex-2-enone
Isooctopherone
Isoforon
Izoforon
3,5,5-Trimethyl-2-cyclohexen-1-one
2-Cyclohexen-1-one, 3,5,5-trimethyl-
alpha-Isophorone
1,1,3-Trimethyl-3-cyclohexene-5-one
Isophoron
3,5,5-Trimethyl-2-cyclohexenone
.alpha.-Isophoron
NCI-C55618
3,5,5-Trimethyl-2-cyclohexen-1-on
UNII-2BR99VR6WA
3,5,5-Trimetil-2-cicloesen-1-one
.alpha.-Isophorone
Isophorone, 97%
NSC 403657
3,5,5-Trimethyl-2-cyclohexene-1-one
2BR99VR6WA
CHEBI:34800
NSC4881
3,5,5-Trimethylcyclohexen-2-one-1
3,3,5-Trimethyl-2-cyclohexen-1-one
DSSTox_CID_759
DSSTox_RID_75774
DSSTox_GSID_20759
Izoforon
3,5-Trimethyl-2-cyclohexenone
Isoforone
Caswell No. 506
3,5-Trimetil-2-cicloesen-1-one
3,5-Trimethyl-2-cyclohexen-1-one
1,3-Trimethyl-3-cyclohexene-5-one
3,5-Trimethyl-2-cyclohexene-1-one
WLN: L6V BUTJ C1 D1 D1
2-Cyclohexen-1-one,5,5-trimethyl-
CAS-78-59-1
FEMA No. 3553
CCRIS 1353
HSDB 619
ISOPHORONE, REAG
EINECS 201-126-0
3,5-Trimethyl-2-cyclohexen-1-on
EPA Pesticide Chemical Code 047401
BRN 1280721
3,5,5-Trimethylcyclohexenone
a-Isophorone
AI3-00046
3,5,5-Trimethylcyclohexen one
alpha -isophoron
alpha -isophorone
3,5,5-Trimetil-2-cicloesen-1-one
nchem.180-comp3
3,5,5-Trimethyl-2-cyclohexen-1-on
1,5,5-Trimethyl-1-cyclohexen-3-one
Isophorone Reagent Grade
EC 201-126-0
SCHEMBL22522
Isophorone, >=97%, FG
4-07-00-00165
BIDD:ER0627
Isophorone, analytical standard
CHEMBL1882894
DTXSID8020759
FEMA 3553
3,5,5-trimethyl-cyclohex-2-enone
HY-Y0932
Isophorone-2,4,4,6,6-
NSC-4881
Tox21_202312
Tox21_300050
BBL027346
MFCD00001584
NSC403657
s2998
STK801792
ZINC14822379
AKOS000120392
3,5,5-trimethylcyclohex-2-ene-1-one
3,5,5-trimethylcyclohexa-2-en-1-one
MCULE-5564101474
NSC-403657
3,3,5-trimethyl-cyclohex-5-en-1-one
3,5,5-trimethyl-cyclohex-2-en-1-one
1,1, 3-Trimethyl-3-cyclohexene-5-one
3,5, 5-Trimethyl-2-cyclohexene-1-one
NCGC00164006-01
NCGC00164006-02
NCGC00164006-03
NCGC00254115-01
NCGC00259861-01
3,3,5-trimethyl-cyclohex-5 -en-1-one
AC-10580
K387
VS-08530
Isophorone, Vetec(TM) reagent grade, 97%
CS-0015924
FT-0627443
I0151
D72515
A839454
Q415519
W-104274
F0001-2053
201-126-0
2BR99VR6WA
2-Cyclohexen-1-one, 3,5,5-trimethyl-
3,5,5-Trimethyl-2-cyclohexen-1-on
3,5,5-Trimethyl-2-cyclohexen-1-on
3,5,5-Trimethyl-2-cyclohexen-1-one
3,5,5-Triméthyl-2-cyclohexén-1-one
3,5,5-Trimethylcyclohex-2-en-1-one
78-59-1
GW7700000
Isophorone
L6V BUTJ C1 E1 E1
异佛尔酮
1,1,3-trimethyl-3-cyclohexene-5-one
1,5,5-Trimethyl-1-cyclohexen-3-one
14397-59-2
2-Cyclohexen-1-one, 3,5, 5-trimethyl-
3,3,5-Trimethyl-2-cyclohexen-1-one
3,3,5-trimethyl-2-cyclohexene-1-one
3,5,5-trimethyl-1-cyclohex-2-enone
3,5,5-Trimethyl-2-cyclohexen-1-on
3,5,5-Trimethyl-2-cyclohexene-1-one
3,5,5-trimethylcyclohex-2-enone
3,5,5-Trimethylcyclohexen one
3,5,5-Trimethylcyclohexen-2-one-1
3,5,5-Trimethylcyclohexenone
3,5,5-Trimetil-2-cicloesen-1-one
3,5,5-Trimetil-2-cicloesen-1-one
4-07-00-00165
a-Isophorone
BB_NC-0161
Cyclohex-2-en-1-one, 3,5,5-trimethyl-
Diisophorone
EINECS 201-126-0
FEMA 3553
Isoacetophorone
Isoforon
Isoforone
Isoforone
Isooctopherone
Isophoron
ISOPHORONE (3-METHYL-D3, 2,4,4,6,6-D5)
Isophorone;3,5,5-Trimethyl-2-cyclohexene-1-one
ISOPHORONE-2,4,4,6,6-D5
Izoforon
Izoforon
l04130
NCGC00164006-01
ST5330654
UNII:2BR99VR6WA
UNII-2BR99VR6WA
VS-08530
WLN: L6V BUTJ C1 D1 D1
α -isophoron
α -isophorone
α-Isophoron
α-isophorone
α-Isophorone

ISOPHTHALIC ACID; Benzene-1,3-dicarboxylic acid; Isophthalic acid; meta-Phthalic acid cas no: 121-91-5

Isophorone diamine (IPDA) is a chemical compound with the molecular formula C9H18N2.
Isophorone diamine (IPDA) is an organic compound and a diamine, specifically a derivative of isophorone.
Isophorone diamine is characterized by its branched structure and two amino groups (-NH2) attached to the carbon chain.

CAS Number: 2855-13-2
EC Number: 220-561-5

Synonyms: sophorone diamine, IPDA, 3-Aminomethyl-3,5,5-trimethylcyclohexylamine, Isoaminomethylcyclohexane, 3,5-Bis(aminomethyl)-3-methylcyclohexylamine, 3,5-Bis(aminomethyl)-3-methylcyclohexane, 3-Aminomethyl-3,5,5-trimethylcyclohexanamine, 3,5-Dimethyl-3,5-diaminomethylcyclohexane, 3,5-Dimethyl-3,5-diaminomethylcyclohexylamine, Isophoronediaamine



APPLICATIONS


Isophorone diamine (IPDA) is primarily used as a curing agent in epoxy resin formulations.
Isophorone diamine (IPDA) is essential in the production of epoxy coatings used for corrosion protection in industrial and marine environments.

Isophorone diamine (IPDA) is employed in the manufacturing of epoxy adhesives, ensuring strong bonding capabilities across various substrates.
Isophorone diamine (IPDA) is used in composite materials for enhancing mechanical properties such as strength and durability.

Isophorone diamine (IPDA) finds application in the formulation of epoxy-based composites used in aerospace components.
Isophorone diamine (IPDA) contributes to the production of epoxy flooring systems known for their abrasion resistance and chemical durability.

In the automotive industry, IPDA-based epoxy coatings are used to enhance the durability and appearance of vehicle parts.
Isophorone diamine (IPDA) is utilized in the construction sector for producing high-performance structural adhesives and sealants.

IPDA-modified epoxy resins are employed in electrical applications for their insulation properties and heat resistance.
Isophorone diamine (IPDA) plays a role in the formulation of protective coatings for pipelines and storage tanks in the oil and gas industry.

Isophorone diamine (IPDA) is used in the production of electrical encapsulation materials for protecting sensitive components.
Isophorone diamine (IPDA) is crucial in the manufacturing of industrial laminates and composites used in machinery and equipment.

Isophorone diamine (IPDA) finds application in the formulation of epoxy-based paints and varnishes for decorative and protective purposes.
Isophorone diamine (IPDA) is utilized in the formulation of adhesives for bonding composite materials in wind turbine blades.

IPDA-based epoxy formulations are used in the marine industry for shipbuilding and offshore applications.
Isophorone diamine (IPDA) contributes to the production of epoxy-based floorings in commercial and residential buildings.

Isophorone diamine (IPDA) is used in the formulation of potting compounds and encapsulants for electronics and electrical assemblies.
Isophorone diamine (IPDA) is employed in the production of epoxy-based coatings for concrete surfaces in infrastructure projects.

IPDA-modified epoxy resins are utilized in the aerospace industry for manufacturing lightweight structural components.
Isophorone diamine (IPDA) finds application in the formulation of corrosion-resistant coatings for steel structures and bridges.
Isophorone diamine (IPDA) is used in the formulation of epoxy adhesives for bonding and repairing industrial equipment.

Isophorone diamine (IPDA) contributes to the production of composite materials used in sporting goods and recreational equipment.
Isophorone diamine (IPDA) is employed in the formulation of epoxy-based coatings for water and wastewater treatment facilities.

Isophorone diamine (IPDA)'s versatility extends to the production of epoxy mortars and grouts used in construction.
Isophorone diamine (IPDA) plays a crucial role in various industries, enhancing the performance, durability, and reliability of epoxy resin-based materials and products.

Isophorone diamine (IPDA) is widely used as a curing agent in epoxy resin systems due to its excellent reactivity.
Isophorone diamine (IPDA) plays a crucial role in the production of epoxy coatings, providing enhanced corrosion resistance to metal surfaces.

IPDA-based coatings are used in industrial settings such as chemical plants, oil refineries, and offshore platforms.
Isophorone diamine (IPDA) is integral to the formulation of epoxy adhesives, ensuring strong bonds between various substrates.
Isophorone diamine (IPDA) is utilized in structural adhesives for bonding metals, composites, and plastics in automotive and aerospace applications.

Isophorone diamine (IPDA) enhances the durability and mechanical strength of epoxy-based composites used in aerospace components.
In the construction industry, IPDA is used in epoxy flooring systems known for their abrasion resistance and chemical resilience.

Isophorone diamine (IPDA) contributes to the formulation of protective coatings for concrete surfaces in infrastructure projects.
IPDA-modified epoxy resins are essential in producing electrical insulation materials for the electronics industry.
Isophorone diamine (IPDA) is employed in the manufacture of potting compounds and encapsulants to protect electronic components from environmental factors.

Isophorone diamine (IPDA) finds application in the production of epoxy-based paints and varnishes used for decorative and protective purposes.
Isophorone diamine (IPDA) is crucial in the production of industrial laminates and composite materials used in machinery and equipment.

Isophorone diamine (IPDA) is used in the formulation of corrosion-resistant coatings for pipelines, storage tanks, and marine structures.
IPDA-based epoxy coatings are used in the automotive sector to improve the durability and aesthetic appeal of vehicle parts.
Isophorone diamine (IPDA) is employed in the formulation of adhesives and sealants for bonding construction materials and assemblies.

Isophorone diamine (IPDA) finds use in the manufacturing of epoxy-based composites for sporting goods and recreational equipment.
Isophorone diamine (IPDA) contributes to the production of epoxy mortars and grouts used in construction and repair applications.
Isophorone diamine (IPDA) is utilized in the aerospace industry for manufacturing lightweight structural components and composite materials.

IPDA-modified epoxy formulations are used in the marine sector for shipbuilding and offshore structures.
Isophorone diamine (IPDA) is employed in the formulation of epoxy-based coatings for water and wastewater treatment facilities.
Isophorone diamine (IPDA)'s versatility extends to the production of epoxy-based flooring systems in commercial and residential buildings.

Isophorone diamine (IPDA) plays a role in the formulation of epoxy adhesives used in woodworking, furniture manufacturing, and cabinetry.
Isophorone diamine (IPDA) contributes to the production of epoxy-based coatings for agricultural equipment, enhancing durability and corrosion resistance.

Isophorone diamine (IPDA) is integral in the formulation of protective coatings for steel structures, bridges, and infrastructure projects.
Isophorone diamine (IPDA) is a versatile compound that enhances the performance, durability, and reliability of epoxy resin-based materials across various industries.

Isophorone diamine (IPDA)'s versatility extends to the production of flooring materials, where abrasion resistance is essential.
Isophorone diamine (IPDA) is known for its compatibility with various additives and fillers, enhancing the versatility of epoxy formulations.

IPDA-modified resins exhibit good flexibility and impact resistance, making them suitable for diverse engineering applications.
Isophorone diamine (IPDA)'s stability under different environmental conditions ensures long-term performance in outdoor applications.

Isophorone diamine (IPDA)'s low viscosity facilitates easy handling and processing during formulation.
Isophorone diamine (IPDA) is subject to strict handling protocols due to its potential for skin and eye irritation.

Proper ventilation and personal protective equipment (PPE) are necessary when handling IPDA to minimize exposure risks.
Isophorone diamine (IPDA) is regulated for its toxicity and environmental impact, requiring careful management in industrial settings.
Isophorone diamine (IPDA) is a versatile compound widely recognized for its role in enhancing the performance and durability of epoxy resin-based products across various industries.



DESCRIPTION


Isophorone diamine (IPDA) is a chemical compound with the molecular formula C9H18N2.
Isophorone diamine (IPDA) is an organic compound and a diamine, specifically a derivative of isophorone.
Isophorone diamine is characterized by its branched structure and two amino groups (-NH2) attached to the carbon chain.

Isophorone diamine (IPDA) is a branched diamine compound derived from isophorone.
Isophorone diamine (IPDA) is characterized by its molecular structure, consisting of a cycloaliphatic backbone with two amino groups (-NH2).

Isophorone diamine (IPDA) is typically a clear to pale yellow liquid at room temperature.
Isophorone diamine (IPDA) exhibits a distinct amine-like odor.
Isophorone diamine (IPDA) is soluble in polar solvents such as water and alcohols.

Isophorone diamine (IPDA) is known for its high reactivity in epoxy resin systems.
In industrial applications, it serves primarily as a curing agent for epoxy resins.

Isophorone diamine (IPDA) plays a vital role in cross-linking reactions, leading to the formation of strong and durable polymer networks.
Isophorone diamine (IPDA) is valued for its ability to improve the mechanical strength and chemical resistance of epoxy-based materials.
Isophorone diamine (IPDA) is widely used in the formulation of coatings and adhesives due to its excellent bonding properties.

Isophorone diamine (IPDA) contributes to the production of corrosion-resistant coatings for metals.
Isophorone diamine (IPDA) is essential in composite materials where enhanced durability is required.

Isophorone diamine (IPDA) is employed in electrical insulation applications for its thermal stability.
Isophorone diamine (IPDA) is crucial in the automotive industry for manufacturing high-performance coatings and structural materials.

Isophorone diamine (IPDA)'s chemical structure allows it to react efficiently with epoxy resins, ensuring uniform curing and excellent adhesion.
IPDA-based formulations are used in aerospace applications for their lightweight and durable properties.



PROPERTIES


Physical Properties:

Appearance: Clear to pale yellow liquid
Odor: Characteristic amine-like odor
Density: Approximately 0.92 g/cm³ at 20°C
Boiling Point: Approximately 203-205°C
Melting Point: Approximately -10°C
Solubility in Water: Soluble
Solubility in Other Solvents: Soluble in polar solvents such as alcohols and acetone
Flash Point: Approximately 96°C (closed cup)
Viscosity: Moderate viscosity at room temperature


Chemical Properties:

Chemical Formula: C9H18N2
Molecular Weight: Approximately 154.25 g/mol
Structural Formula:
IPDA has a cycloaliphatic structure with two amino groups (-NH2) attached to the carbon chain.
CAS Number: 2855-13-2
EC Number: 220-561-5
pH: Neutral in aqueous solutions
Reactivity: Highly reactive with epoxy resins, forming cross-linked networks.
Hygroscopicity: Low hygroscopicity
Acidity/Basicity: Basic compound due to amino groups
Flammability: Not flammable under normal conditions



FIRST AID


Inhalation:

Move to Fresh Air:
If IPDA vapors are inhaled, immediately remove the affected person to fresh air.

Provide Oxygen:
If breathing is difficult, provide oxygen if trained to do so.

Seek Medical Attention:
Seek medical attention immediately. Keep the person calm and reassured.


Skin Contact:

Remove Contaminated Clothing:
Quickly and gently remove any contaminated clothing and shoes.

Wash Skin Thoroughly:
Wash the affected skin with plenty of soap and water for at least 15 minutes.

Use Mild Soap:
Use a mild soap and avoid scrubbing to prevent skin irritation.

Seek Medical Attention:
If irritation persists or develops, seek medical attention promptly.


Eye Contact:

Flush Eyes:
Immediately flush eyes with plenty of water, occasionally lifting the upper and lower eyelids.

Continue Flushing:
Continue flushing for at least 15 minutes, ensuring water reaches under eyelids.

Seek Medical Attention:
Seek immediate medical attention, even if symptoms such as redness or irritation are not present.


Ingestion:

Do NOT Induce Vomiting:
Do not induce vomiting unless instructed to do so by medical personnel.

Rinse Mouth:
If the person is conscious and able to swallow, rinse mouth thoroughly with water.

Seek Medical Attention:
Seek immediate medical attention. Provide medical personnel with product information and SDS if available.



HANDLING AND STORAGE


Handling:

Personal Protective Equipment (PPE):

Wear chemical-resistant gloves, safety goggles, and protective clothing (long sleeves and pants) when handling IPDA.
Use respiratory protection (such as a NIOSH-approved respirator) if handling in poorly ventilated areas or during prolonged exposure.


Engineering Controls:

Use local exhaust ventilation systems to control airborne concentrations and minimize exposure to IPDA vapors.
Ensure adequate general ventilation in the workplace to maintain air quality and reduce inhalation risks.


Avoid Direct Contact:

Avoid skin and eye contact with IPDA.
In case of skin contact, promptly remove contaminated clothing and wash skin thoroughly with soap and water.
In case of eye contact, immediately flush eyes with plenty of water for at least 15 minutes and seek medical attention.


Handling Precautions:

Handle IPDA in a well-ventilated area or under a fume hood to minimize exposure to vapors.
Do not eat, drink, or smoke while handling IPDA, and wash hands thoroughly after handling.


Spill and Leak Procedures:

In case of a spill, contain the spill immediately using absorbent materials and prevent entry into waterways or sewers.
Wear appropriate PPE during cleanup and follow spill cleanup procedures as outlined in the SDS (Safety Data Sheet).


Storage Compatibility:

Store IPDA in tightly closed containers made of chemical-resistant materials such as stainless steel or polyethylene.
Ensure storage containers are properly labeled with product name, hazard warnings, and handling precautions.
Store away from sources of heat, ignition, and direct sunlight.


Storage:

Temperature and Humidity:

Store IPDA at room temperature, typically between 20°C to 25°C (68°F to 77°F).
Avoid exposure to extreme temperatures and humidity to prevent degradation or changes in chemical properties.


Segregation:

Store IPDA away from incompatible substances such as strong acids, oxidizers, and reactive chemicals.
Keep storage areas well-ventilated and free from potential sources of contamination.


Handling Guidance:

Train personnel on safe handling practices, emergency procedures, and proper use of PPE when working with IPDA.
Conduct regular inspections of storage areas for leaks, spills, or signs of deterioration in containers.


Emergency Response Preparedness:

Maintain spill control materials, fire extinguishing equipment, and emergency eyewash stations in areas where IPDA is handled or stored.
Ensure personnel are familiar with emergency response protocols and contact information for local emergency services.

DESCRIPTION:
Isophorone diamine (usually shortened to IPDA) is a chemical compound and specifically a diamine with the formula (CH3)3C6H7(NH2)(CH2NH2).
Isophorone diamine (IPDA) is a colorless liquid.
Isophorone diamine (IPDA) is a precursor to polymers and coatings.

CAS Number: 2855-13-2
European Community (EC) Number: 220-666-8
Molecular formula : C 1 0 H 2 2 N 2
IUPAC Name: 3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine


SYNONYMS OF ISOPHORONE DIAMINE (IPDA):
IPDA;ISOPHORONEDIAMINE;ipd;DAIP;D 230;Isophorondiamin;3-AMINOMETHYL-3,5,5-TRIMETHYLCYCLOHEXYLAMINE;5-AMINO-1,3,3-TRIMETHYLCYCLOHEXANEMETHYLAMINE;5-amino-1,3,3-trimethyl-cyclohexanemethanamin;3-(AMinoMethyl)-3,5,5-triMethylcyclohexanaMine, Cyclohexanemethylamine,5-amino-1,3,3-trimethyl- (7CI,8CI);1,3,3-Trimethyl-1-aminomethyl-5-aminocyclohexane;1-Amino-3,3,5-trimethyl-5-aminomethylcyclohexane;1-Amino-3-(aminomethyl)-3,5,5-trimethylcyclohexane;3,3,5-Trimethyl-5-aminomethylcyclohexylamine;3-Aminomethyl-3,5,5-trimethyl-1-cyclohexylamine;3-Aminomethyl-3,5,5-trimethylcyclohexylamine;5-Amino-1,3,3-trimethylcyclohexanemethanamine;Araldite HY 5083;Araldite HY5161;Chemammina CA 17;Epilox H 10-31;Epilox IPD;HY 3484;HY 5161;IPD;IPDA;Isophorone diamine;LH 281;Luxam IPD;Polypox IPD;Rutadur SG;Rutapox H550L;Vestamin IPD;Vestamine IPDA;, 5-Amino-1,3,3-Trimethyl Cyclohexanemethanamine;,1-Amino-3-aminomethyl-3,5,5-trimethyl cyclohexane; 3-Aminomethyl-3,5,5-trimethyl cyclohexylamine; 3-Aminomethyl-3,5,5-trimethylcyclohexylamin (German); 3-Aminometil-3,5,5-trimetilciclohexilamina (Spanish); 3-Aminométhyl-3,5,5-triméthyl cyclohexylamine (French);,3-AMINOMETHYL-3,5,5-TRIMETHYLCYCLOHEXYLAMINE,5-AMINO-1,3,3-TRIMETHYLCYCLOHEXANEMETHYLAMINE,5-AMINO-1,3,3-TRIMETHYL CYCLOHEXANEMETHANAMINE,AMINO-5 TRIMETHYL-1,3,3 CYCLOHEXANEMETHYLAMINE,AMINOMETHYL-3 TRIMETHYL-3,5,5 CYCLOHEXYLAMINE,CYCLOHEXANEMETHANAMINE, 5-AMINO-1,3,3-TRIMETHYL-,CYCLOHEXANEMETHYLAMINE, 5-AMINO-1,3,3-TRIMETHYL-,Isophorone diamine,3-aminomethyl-3,5,5-trimethylcyclohexylamine,isophorone diamine,isophorone diamine, 4-methylbenzenesulfonate,isophoronediamine,ISOPHORONE DIAMINE,2855-13-2,Isophoronediamine,Isophorondiamine,3-Aminomethyl-3,5,5-trimethylcyclohexylamine,Cyclohexanemethanamine, 5-amino-1,3,3-trimethyl-,3-(Aminomethyl)-3,5,5-trimethylcyclohexanamine,3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine,5-Amino-1,3,3-trimethylcyclohexanemethylamine,Cyclohexanemethylamine, 5-amino-1,3,3-trimethyl-,DTXSID6027503,1-Amino-3-aminomethyl-3,5,5-trimethylcyclohexane,DTXCID907503,CAS-2855-13-2,IPDA,CCRIS 6680,HSDB 4058,EINECS 220-666-8,UN2289,UNII-X5WYA841BU,Vestamin IPD,Araldite HY 5083,EC 220-666-8,X5WYA841BU,SCHEMBL15383,SCHEMBL8745864,CHEMBL1876029,Tox21_201401,Tox21_303122,MFCD00019397,AKOS000120367,MCULE-8499525000,UN 2289,NCGC00164044-01,NCGC00164044-02,NCGC00257083-01,NCGC00258952-01,LS-13908,Isophoronediamine [UN2289] [Corrosive],I0228,NS00010871,3,3,5-Trimethyl-5-aminomethylcyclohexylamine,5-Amino-1,3,3-trimethylcyclohexanemethanamine,EN300-20211,3-Aminomethyl-3,5,5-trimethyl cyclohexylamine,1,3,3-Trimethyl-1-aminomethyl-5-aminocyclohexane,1-Amino-3,3,5-trimethyl-5-aminomethylcyclohexane,3-(Aminomethyl)-3,5,5-trimethylcyclohexanamine #,1-amino-3,3,5-trimethyl-5-aminomethyl cyclohexane,1-amino-3-aminomethyl-3,5,5-trimethyl cyclohexane,1-aminomethyl-5-amino-1,3,3-trimethyl cyclohexane,J-017123,Q1674522,1-Amino-3-(aminomethyl)-3,5,5-trimethylcyclohexane,F2191-0270


Isophoronediamine appears as a clear to light-yellow liquid.
Isophorone diamine (IPDA) is Highly soluble though slightly denser than water.
Isophorone diamine (IPDA) May be toxic by inhalation and skin absorption.

Isophorone diamine (IPDA) is Corrosive to skin.
Isophorone diamine (IPDA) is Used to make other chemicals.

Isophorone diamine (IPDA) is a curing agent.
Isophorone diamine (IPDA) is a mixture of cis and trans isomers.
Isophorone diamine (IPDA) is used in the manufacturing of diisocyanates, composites and polyamides.
Isophorone diamine (IPDA) is suitable for flooring, paving aggregates and other epoxy coatings and resins.



PRODUCTION OF ISOPHORONE DIAMINE (IPDA):
Isophorone diamine (IPDA) is usually produced as a mixture of the cis- and trans-isomers.
Isophorone diamine (IPDA) is produced by hydrocyanation of isophorone followed by reductive amination and hydrogenation of the nitrile.

USES OF ISOPHORONE DIAMINE (IPDA):
Isophorone diamine (IPDA) is used as a precursor in the manufacture of isophorone diisocyanate by phosgenation.
Like other diamines or amines in general, it is a curing agent for epoxy resins.
When used in coatings applications the higher cost compared to other amines is justified by the enhanced UV stability and thus lower yellowing tendency.

In the production of advanced composite materials (engineering) its higher cost compared to other amines is less critical as performance is the key criteria.
Cycloaliphatic amines such as IPDA also are known to have lower yellowing tendency than other amines and are thus used in coatings applications where this feature is important for aesthetics.

Although it is not the only cycloaliphatic amine used in epoxy flooring, it has the largest use by volume.
Other cycloaliphatic amines used in flooring include 1,3-BAC, MXDA, PACM and DCH-99.
In laboratory tests, Tokyo Metropolitan University found that IPDA was able to remove more than 99 percent of CO2 from air with a concentration of 400 parts per million (ppm) – about the level currently in the atmosphere.

This process also happened much faster than other carbon capture techniques, removing 201 millimoles of CO2 per hour, per mole of the compound.
That is at least twice as fast as other Direct Air Capture lab systems, and far faster than the leading artificial leaf device.
The pollutant separated out into flakes of a solid carbamic acid material, which could be removed from the liquid relatively easily.

If need be, it can be converted back into gaseous CO2 by heating it to 60 °C (140 °F), which also releases the original liquid IPDA ready for reuse.
Whether the carbon is kept as a solid or a gas, it can then be stored or reused in industrial or chemical processes.
The research was published in the journal ACS Environmental Au.



Isophorone diamine (IPDA) is a colorless transparent liquid with an amine-like odor at room temperature.
Isophorone diamine (IPDA) is widely used in epoxy, polyurethane and polyamide industry.

Isophorone Diamine (IPDA) is an organic compound in the class known as isocyanates.
More specifically, Isophorone diamine (IPDA) is an aliphatic diisocyanate.
Isophoronediamine appears as a clear to light-yellow, water soluble liquid.
Generally Isophorone diamine (IPDA) is used as an intermediate for preparation of other chemicals


APPLICATIONS OF ISOPHORONE DIAMINE (IPDA):
Isophorone Diamine (IPDA) is a cross linker for epoxy resins, building block for polyamides.
Isophorone diamine (IPDA) is used in epoxy coatings, epoxy adhesives and epoxy composites.
Isophorone diamine (IPDA) improves the hydrophobicity of epoxy resins with less sensitivity against humidity while film formation.


Diamines are compounds which contain two amino groups.
Both aliphatic (linear or branched from short C-2 chain to fatty length ) and aromatic diamines are used as a monomer to form copolymers like nylons, polyesters and polyurethanes for characteristic properties.
They can form a protein-like structure at both ends of each monomer.

The chain length characteristics with recurring amide groups provide a variety physical properties and are further processed into various applications including plastics, oil-modified and moisture-area types of urethane coatings, polyamides for printing inks, dimer acids, textiles, lubricant additive as scale and corrosion inhibitor, epoxy curing agent, isocyanates, water treatment chemicals, biocides, and pharmaceutical intermediates.
Cycloaliphatic diamines are used in urethane and epoxy coatings for light-stable, weather-resistant properties.

Isophorone diamine (IPDA) is used in water proofing and paving concreting.
Isophorone diamine (IPDA) is used in manufacturing diisocyanates and polyamides.
Common cycloaliphatic diamines include isophorone diamine, 1,2-diaminocyclohexane, 1,4-bis(aminocyclohexyl)methane, 1,3-bis(aminomethyl)cyclohexane, bis(aminomethyl)norbornane.

They are versatile intermediate to produce leather, rubber products, plastics, pesticides, dyes, and photo sensitive polymers.
Isophorone diamine (IPDA) is used in manufacturing diisocyanates and polyamides.
Aliphatic diamines are the most common epoxy curing agent.


CHEMICAL AND PHYSICAL PROPERTIES OF ISOPHORONE DIAMINE (IPDA)
Chemical formula C10H22N2
Molar mass 170.300 g•mol−1
Appearance Colourless liquid
Density 0.922
Melting point 10 °C (50 °F; 283 K)
Boiling point 247 °C (477 °F; 520 K)
Solubility in water Very good
Refractive index (nD) 1.4880
Molecular Weight
170.30 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
XLogP3-AA
1.1
Computed by XLogP3 3.0 (PubChem release 2021.10.14)
Hydrogen Bond Donor Count
2
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Hydrogen Bond Acceptor Count
2
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Rotatable Bond Count
1
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Exact Mass
170.178298710 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Monoisotopic Mass
170.178298710 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Topological Polar Surface Area
52Ų
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Heavy Atom Count
12
Computed by PubChem
Formal Charge
0
Computed by PubChem
Complexity
165
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Isotope Atom Count
0
Computed by PubChem
Defined Atom Stereocenter Count
0
Computed by PubChem
Undefined Atom Stereocenter Count
2
Computed by PubChem
Defined Bond Stereocenter Count
0
Computed by PubChem
Undefined Bond Stereocenter Count
0
Computed by PubChem
Covalently-Bonded Unit Count
1
Computed by PubChem
Compound Is Canonicalized
Yes
CAS number 2855-13-2
EC index number 612-067-00-9
EC number 220-666-8
Hill Formula C₁₀H₂₂N₂
Molar Mass 170.3 g/mol
HS Code 2921 30 99
Boiling point 247 °C (1013 hPa)
Density 0.924 g/cm3 (20 °C)
Explosion limit 1.2 %(V)
Flash point 110 °C
Ignition temperature 380 °C
Melting Point 10 °C
pH value 11.6 (10 g/l, H₂O, 20 °C)
Vapor pressure 0.0157 hPa (20 °C)
Water 0.06 %
Color Number 3
APHA Amino Nitrile 0.0 %
Isophorondiamine 99.9 %
vapor pressure
0.02 hPa ( 20 °C)
Quality Level
200
form
liquid
autoignition temp.
380 °C
potency
1030 mg/kg LD50, oral (Rat)
expl. lim.
1.2 % (v/v)
pH
11.6 (20 °C, 10 g/L in H2O)
bp
247 °C/1013 hPa
mp
10 °C
transition temp
flash point 112 °C
density
0.92 g/cm3 at 20 °C
storage temp.
2-30°C
InChI
1S/C10H22N2.C7H8O3S/c1-9(2)4-8(12)5-10(3,6-9)7-11;1-6-2-4-7(5-3-6)11(8,9)10/h8H,4-7,11-12H2,1-3H3;2-5H,1H3,(H,8,9,10)
InChI key
ZBVBXDSQFYHMPD-UHFFFAOYSA-N

Melting point 10 °C(lit.)
Boiling point 247 °C(lit.)
Density 0.924 g/mL at 20 °C(lit.)
vapor pressure 0.02 hPa (20 °C)
refractive index n20/D 1.490
Flash point >230 °F
storage temp. Store below +30°C.
solubility Chloroform (Slightly), Methanol (Slightly)
pka 10.57±0.70(Predicted)
form Liquid
color Clear
PH 11.6 (10g/l, H2O, 20℃)
explosive limit 1.2%(V)
Viscosity 19mm2/s
Water Solubility miscible
Stability Stable. Incompatible with strong oxidizing agents.
InChIKey RNLHGQLZWXBQNY-UHFFFAOYSA-N
LogP 0.99 at 23℃
CAS DataBase Reference 2855-13-2(CAS DataBase Reference)
Indirect Additives used in Food Contact Substances 3-AMINOMETHYL-3,5,5-TRIMETHYLCYCLOHEXYLAMINE
FDA 21 CFR 175.105
EWG's Food Scores 5
FDA UNII X5WYA841BU
EPA Substance Registry System Isophorone diamine (2855-13-2)
PHYSICAL STATE Clear liquid
MELTING POINT 10 C
BOILING POINT 245 - 247 C
SPECIFIC GRAVITY 0.920 - 0.925
SOLUBILITY IN WATER Miscible
pH
11.5 - 12.5 (10% Sol.)
VAPOR DENSITY 5.9
AUTOIGNITION
380 C
NFPA RATINGS Health: 3; Flammability: 1; Reactivity: 0
REFRACTIVE INDEX
1.4877
FLASH POINT
112 C
STABILITY Stable under ordinary conditions. Hygroscopic.

Isophthalic Acid is also known as 1,3-phthalic acid and Isophthalic Acid.
Isophthalic Acid is a white crystalline powder or acicular crystal.


CAS Number: 121-91-5
EC Number: 204-506-4
MDL number: MFCD00002516
Molecular Formula: C8H6O4 / C6H4(COOH)2


Isophthalic Acid's melting point is from 345 degrees to 347 degrees and it can be sublimated.
Isophthalic Acid can be easily soluble in methanol, ethanol, acetone, and Glacial acetic acid.
Isophthalic Acid is slightly soluble in boiling water, but insoluble in benzene, toluene, and petroleum ether.


Isophthalic acid has strong heat resistance, hydrolysis resistance, and chemical resistance.
Isophthalic acid is a colorless crystalline solid.
Nearly pure isophthalic acid has a purity of >99.8%.


This material is called purified isophthalic acid or PIA.
Isophthalic Acid has excellent performance characteristics including exceptional hardness, corrosion and stain resistance, hydrolytic stability of coatings and gel coats, outstanding thermal stability and low resin color in coatings industry.


Isophthalic Acid is an organic compound with the molecular formula C8H6O4.
Isophthalic Acid’s a colourless solid and it’s an isomer of phthalic acid and terephthalic acid.
Isophthalic Acid (PIA) is an organic compound.


This is an isomer of Phthalic acid and Terephthalic acid.
Isophthalic Acid is used as an intermediate in the production of unsaturated polyester resins, followed by polyester and alkyd resins (mainly for surface coatings) and inks, reinforced plastics and packaging applications.


Purified Isophthalic Acid is also used as a comonomer in the production of Polyethylene Terephthalate (PET) bottle resins.
Isophthalic Acid provides excellent hardness, corrosion and stain resistance, hydrolytic and thermal stability, and low resin levels.
Isophthalic Acid, also known as PIA or PIPA, is an organic compound with the formula C6H4(CO2H)2.


Isophthalic Acid, is an aromatic dicarboxylic acid, an isomer of phthalic acid and terephthalic acid.
Isophthalic Acid is insoluble in water.
Isophthalic Acid is incompatible with strong oxidizing agents and strong bases.


Isophthalic Acid is a carboxylic acid.
Isophthalic Acid is registered under the REACH Regulation and is manufactured in and / or imported to the European Economic Area, at ≥ 100 000 tonnes per annum.


Isophthalic Acid is an organic compound with the formula C6H4(CO2H)2.
This colorless solid, Isophthalic Acid, is an isomer of phthalic acid and terephthalic acid.
Isophthalic Acid is one of three isomers of benzenedicarboxylic acid, the others being phthalic acid and terephthalic acid.


Isophthalic acid is a white solid with a slight unpleasant odor.
Isophthalic acid sinks in water.
Isophthalic Acid is a benzenedicarboxylic acid that is benzene substituted by carboxy groups at position 1 and 3.


One of three possible isomers of benzenedicarboxylic acid, the others being phthalic and terephthalic acids.
Isophthalic acid is a conjugate acid of an isophthalate(1-).
Isophthalic acid (PIA) is a non-toxic organic compound with the formula C6H4(CO2H)2.


This colorless solid, Isophthalic Acid, is an isomer of phthalic acid and terephthalic acid.
The high-performance polymer polybenzimidazole is produced from Isophthalic Acid.
Isophthalic Acid is an organic compound with the molecular formula C6H4 (COOH) 2.


Isophthalic Acid is a colorless solid and is a isomer of phthalic acid and terephthalic acid.
Isophthalic Acid is an important organic dicarboxylic acid for the synthesis of alkyd resins and polyester resins, which is added to the resin reaction to increase the resistance of the resin to water and other chemical agents.


Isophthalic Acid crystals crystallized from water or ethanol are colorless crystals.
The melting point of Isophthalic Acid was 345-348 °c.
Isophthalic Acid can sublimate.


Isophthalic Acid is slightly soluble in water, insoluble in benzene, toluene and petroleum ether, soluble in methanol, ethanol, acetone and acetic acid.
Isophthalic Acid is a colorless solid.
Isophthalic Acid sublimes without decomposition.


Isophthalic acid is an organic compound with the formula C6H4(CO2H)2.
This colourless solid is an isomer of phthalic acid and terephthalic acid.
These aromatic dicarboxylic acids are used as precursors (in form of acyl chlorides) to commercially important polymers, e.g. the fire-resistant material Nomex.


The high-performance polymer poly benzimidazole is produced from iso phthalic acid.
Isophthalic Acid is a benzenedicarboxylic acid that is benzene substituted by carboxy groups at position 1 and 3.
One of three possible isomers of benzenedicarboxylic acid, the others being phthalic and terephthalic acids.


Isophthalic Acid with the formula C6H4(CO2H)2 which also known as Methacrylic acid.
Isophthalic acid is an aromatic organic compound having the chemical formula C6H4(CO2H)2 and meta conformation.
The molar mass of Isophthalic Acid is 166 g/mol.


Also, Isophthalic Acid occurs as a colourless solid compound.
Isophthalic acid is an isomer of phthalic acid and terephthalic acid.
When considering the production process, it can produce isophthalic acid via oxidizing meta-xylene in the presence of oxygen.


This is an industrial-scale production process.
Also, this process requires a catalyst such as cobalt- manganese catalyst.
However, we can produce isophthalic acid in the laboratory via fusion of potassium meta-sulfobenzoate with potassium formate in the presence of chromic acid.


Moreover, Isophthalic Acid is an aromatic compound.
And, Isophthalic Acid is composed of a benzene ring with two carboxylic acid groups substituted to the ring.
Here, one carboxylic acid group is in the meta position compared to the other carboxylic acid group.
Therefore, the two functional groups are separated from each other from one carbon atom of the ring.


Besides, isophthalic acid is insoluble in water.
The major use of Isophthalic Acid is in the production of PET or polyethylene terephthalate polymer material which is useful as a resin.
In addition, we can use Isophthalic Acid for the production of unsaturated polyester resin or UPR.



USES and APPLICATIONS of ISOPHTHALIC ACID:
Isophthalic Acid is used as an intermediate primarily for unsaturated polyester resins and alkyd and polyester coating resins; other applications include use in aramid fibers, as a component of copolyester resins and in high-temperature polymers.
Isophthalic Acid is a key ingredient in FRP (Fiberglass Reinforced Plastics) markets for such products as marine, automotive, and corrosion resistant pipes and tanks.


Polyesters containing Isophthalic Acid are also used extensively in industrial coatings applications for home appliances, automobiles, aluminum siding, and metal office furniture.
Isophthalic Acid is used as an intermediate for polyesters, polyurethane resins, plasticizers.


Isophthalic Acid is used by consumers, in articles, by professional workers (widespread uses), in formulation or re-packing, at industrial sites and in manufacturing.
Isophthalic acid is used as an intermediate for high performance unsaturated polyesters, resins for coatings, high solids paints, gel coats and modifier of polyethylene terephthalate for bottles.


Isophthalic Acid acts as precursors for the fire-resistant material nomex as well as used in the preparation of high-performance polymer polybenzimidazole.
Isophthalic Acid is also employed as an input for the production of insulation materials.
Isophthalic Acid is used in the following products: adhesives and sealants, anti-freeze products, coating products, lubricants and greases and polishes and waxes.


Other release to the environment of Isophthalic Acid is likely to occur from: indoor use (e.g. machine wash liquids/detergents, automotive care products, paints and coating or adhesives, fragrances and air fresheners), outdoor use as processing aid, indoor use in close systems with minimal release (e.g. cooling liquids in refrigerators, oil-based electric heaters) and outdoor use in close systems with minimal release (e.g. hydraulic liquids in automotive suspension, lubricants in motor oil and break fluids).


Other release to the environment of Isophthalic Acid is likely to occur from: outdoor use in long-life materials with low release rate (e.g. metal, wooden and plastic construction and building materials) and indoor use in long-life materials with low release rate (e.g. flooring, furniture, toys, construction materials, curtains, foot-wear, leather products, paper and cardboard products, electronic equipment).


Isophthalic Acid can be found in products with material based on: plastic (e.g. food packaging and storage, toys, mobile phones) and fabrics, textiles and apparel (e.g. clothing, mattress, curtains or carpets, textile toys).
Isophthalic Acid is used in the following products: laboratory chemicals, polymers and coating products.


Release to the environment of Isophthalic Acid can occur from industrial use: manufacturing of the substance, formulation of mixtures, for thermoplastic manufacture, as processing aid and as an intermediate step in further manufacturing of another substance (use of intermediates).
Isophthalic Acid has an industrial use resulting in manufacture of another substance (use of intermediates).


Isophthalic Acid is used for the manufacture of: rubber products and .
Other release to the environment of this substance is likely to occur from: indoor use (e.g. machine wash liquids/detergents, automotive care products, paints and coating or adhesives, fragrances and air fresheners) and outdoor use.


Isophthalic Acid is used in the following products: polymers, inks and toners, adhesives and sealants, coating products, fillers, putties, plasters, modelling clay and finger paints.
Isophthalic Acid has an industrial use resulting in manufacture of another substance (use of intermediates).


Release to the environment of Isophthalic Acid can occur from industrial use: formulation of mixtures, for thermoplastic manufacture, as processing aid, manufacturing of the substance and as an intermediate step in further manufacturing of another substance (use of intermediates).
Isophthalic Acid is used in the following areas: formulation of mixtures and/or re-packaging.


Isophthalic Acid is used in the following products: polymers, coating products, fillers, putties, plasters, modelling clay, adhesives and sealants and inks and toners.
Isophthalic Acid has an industrial use resulting in manufacture of another substance (use of intermediates).


Release to the environment of Isophthalic Acid can occur from industrial use: for thermoplastic manufacture, as processing aid, as an intermediate step in further manufacturing of another substance (use of intermediates), in processing aids at industrial sites, manufacturing of the substance, formulation of mixtures and in the production of articles.


Release to the environment of Isophthalic Acid can occur from industrial use: manufacturing of the substance, as processing aid, as an intermediate step in further manufacturing of another substance (use of intermediates), formulation of mixtures and for thermoplastic manufacture.
The application of Isophthalic Acid is very wide.


Isophthalic Acid can be used to produce coatings, polyester resins, unsaturated polyester resins, special fibers, hot melt adhesives, printing inks, polyester fiber dyeing modifiers, and resin plasticizers.
Isophthalic Acid is mainly used in production of bottle of Polyethylene terephthalate (PET), unsaturated polyester resins, alkyds/polyesters, FRP (Fiberglass Reinforced Plastics), polyurethane resins (insulation materials).


Isophthalic Acid is used in the following areas: formulation of mixtures and/or re-packaging.
Isophthalic Acid is used for the manufacture of: chemicals and plastic products.
Isophthalic Acid improves clarity of bottles, improves thermal/mechanical/chemical resistance of unsaturated polyester resins, increase resistance to water, overall durability & weatherability and hardness of Alkyds/Polyesters.


Together with terephthalic acid, PTA, Isophthalic Acid (CAS: 121-91-5) is used in the production of resins for drink bottles, PET resin.
Isophthalic acid is produced starting from meta-xylene using oxygen, in the presence of a catalyst.
Main application areas for Isophthalic Acid are PET Bottle Grade Resins, Fibres, Low-Melt Fibres, Polyamide Resins, UPR - Unsaturated Polyester Resins, Powder Coating Resins, Coil Coating Resins, Polymer Modifier, Adhesives, High-performance Polymerpolybenzimidazole.


Isophthalic Acid is the industry standard diacid component in high-quality alkyds and polyester resins for industrial coatings and unsaturated polyesters for fiberglass-reinforced plastics applications.
Isophthalic Acid is used as an intermediate primarily for unsaturated polyester resins and alkyd and polyester coating resins; other applications include use in aramid fibers, as a component of copolyester resins and in high-temperature polymers.


Isophthalic Acid is used as an intermediate primarily for unsaturated polyester resins and alkyd and polyester coating resins.
Other applications of Isophthalic Acid include use in aramid fibers, as a component of copolyester resins and in high-temperature polymers.
Isophthalic Acid has three major uses:


Isophthalic Acid reduces the crystallinity of PET, which serves to improve clarity and increase the productivity of bottle-making.
Unsaturated polyester resins, where the addition of Isophthalic Acid improves thermal resistance and mechanical performance, as well as resistance to chemicals and water.


Polyester/alkyd surface coating resins, where Isophthalic Acid increases resistance to water, overall durability and weatherability.
Isophthalic Acid is used as precursors (in form of acyl chlorides) to commercially important polymers, e.g. the fire-resistant material Nomex.
Mixed with terephthalic acid, Isophthalic Acid is used in the production of PET resins for drink plastic bottles and food packaging.


The high-performance polymer polybenzimidazole is produced from Isophthalic Acid.
Also, Isophthalic Acid is used as an important input to produce insulation materials.
These aromatic dicarboxylic acids are used as precursors (in the form of acylchlorides) to commercially important polymers.


The main industrial uses of purified Isophthalic Acid are for the production of polyethylene terephthalate (PET) resin and for the production of unsaturated polyester resin (UPR) and other types of coating resins.
Isophthalic Acid is used to make plastics, unsaturated polyester resins, alkyd resins, polyamides, and thermoplastic polyesters.


Isophthalic Acid is used as a co-monomer with terephthalic acid to make plastic bottles and specialty resins.
Isophthalic Acid is used in formulations for adhesives, inks, wire enamels, and dental materials.
Isophthalic Acid is used for the preparation of alkyd resin, unsaturated polyester resin and other polymers and plasticizers, but also for the production of film coupler, fiber dyeing modifier.


Isophthalic Acid is used for the production of alkyd resin, unsaturated Polyester Resin and other polymers and plasticizers, also used in the manufacture of film coupler, coating and polyester fiber dyeing modifier and medicine.
Isophthalic Acid is used in the manufacture of alkyd resins, unsaturated polyester resins and other high polymers and plasticizers.


Isophthalic Acid is also used in the manufacture of film couplers, coatings and polyester fiber dyeing modifiers and pharmaceuticals.
Aromatic dicarboxylic acids are used as precursors (in the form of acyl chlorides) to commercially important polymers.
Isophthalic Acid is mixed with terephthalic acid and used to make PET resin for beverage bottles and food packaging.


Also, Isophthalic Acid is used as an important raw material for manufacturing insulation.
Isophthalic Acid is used in the food packaging industry, in the automotive industry, the marine products industries, the production of thermostable resins, production pipeline, marine tanks, for producing upholster of the patio furniture and Lawn Mower.


In addition, these materials are used to produce upholster of office furniture and home appliances.
Mixed with terephthalic acid, iso phthalic acid is used in the production of resins for drink bottles.
Polybenzimidazole, a high-performance polymer, is produced from Isophthalic Acid.


Isophthalic Acid is mainly used in the production of bottle PET, also used in the production of alkyd resin, polyester resin, also used in the production of photosensitive materials, pharmaceutical intermediates, and so on.
One of the largest applications for Isophthalic Acid is in unsaturated polyester resins for high-quality gel coats.


The hardness, stain and detergent resistance characteristics of Isophthalic Acid are ideal for polyester solid-surface countertops that are an inexpensive alternative to acrylics.
Isophthalic Acid acts as precursors for the fire-resistant material nomex as well as used in the preparation of high-performance polymer polybenzimidazole.


Isophthalic Acid is also employed as an input for the production of insulation materials.
Isophthalic Acid is used as an intermediate for high performance unsaturated polyesters, resins for coatings, high solids paints, gel coats and modifier of polyethylene terephthalate for bottles.


Isophthalic Acid is mainly used as intermediate for high performance UPR, resins for coatings, high solids paints, gel coats, modifier of PET for bottles.
Isophthalic Acid is a useful reagent for preparing semiconductor sealing materials, prepregs, build-up films, solder resists, dry films, and printed wiring boards.


-Copolyester Polymer
One copolyester polymer can be formed by Isophthalic Acid, terephthalic acid, and ethylene glycol with a mole fraction of 0.01-0.1.
Isophthalic Acid has good tear resistance, impact resistance, melt viscosity, and dyeability.
As a result, Isophthalic Acid can be used for various fibers and film products, like high resilience and heat-bonded polyester fiber, hydrothermal shrinkage blended fiber, soft bulky imitation silk, artificial silk, imitating natural fiber, insulating hollow acid, and alkali resistant polyester fiber, antistatic fiber, etc.


-Low Melt Polyester:
Generally, the melting point of PET polyester produced is about 250℃. While the melting point is about 65℃ for polyester made from 100% isophthalic acid.
If we use 50% Isophthalic Acid to replace Phthalic acid during the production process, the resulting copolymer will have a melting point of about 120°C.

For this reason, the content of Isophthalic Acid can be changed in a wide range according to the requirements of polymer performance.
That’s how we customize the low-melt polyester chips based on different demands.
The filaments made from such PET chips can be used to make flexible fabrics, which are light, soft, and luxurious.

In addition to the thermally-bonded non-woven fabrics, low melt fibers can also be used as fillers to increase the bulkiness of the non-woven fabrics, reduce the weight of the fillers, and increase the thermal insulation performance.
In the manufacture of ultra-fine fibers, the dyeing performance is better than pure PET ultra-fine fibers due to the shrinkage of the crystalline area.


-In coatings Isophthalic Acid:
Isophthalic Acid produces high molecular weight polymers for hardness, flexibility, weatherability, and fast cure in waterborne, powder, and coil coatings.
Isophthalic Acid enhances hydrolytic stability to improve the shelf life of waterborne coatings.
Isophthalic Acid decreases dry times for high solids and traditional solvent-borne coatings.


-In polyester packaging Isophthalic Acid:
Isophthalic Acid provides clear bottles in a range of shapes and sizes and thicker preforms for returnable/refillable containers.
Isophthalic Acid broadens processing window that reduces cycle time and lowers energy requirements.
Isophthalic Acid improves taste in bottled water without the unpleasant flavor of acetaldehyde.
Isophthalic Acid reduces permeability to carbon dioxide and oxygen, keeping beverages carbonated and flavorful longer.


-In unsaturated polyester resins Isophthalic Acid:
Isophthalic Acid provides outstanding resistance to various acids, solvents, and other chemicals.
Isophthalic Acid offers an excellent combination of moderate cost and high performance often matching that of higher cost, corrosion resistant polymers including vinyl esters and bisphenol A polyesters for many applications.

Isophthalic Acid has demonstrated exceptional performance in products as diverse as in-situ pipe remediation, gasoline storage tanks, chemical storage tanks, ladder rails and industrial gratings, protective coatings for watercraft, structural automotive parts and boat hulls, and functional and decorative solid surfaces.

Isophthalic Acid presents ease of synthesis and fabrication in pultrusion, sheet molding compound (SMC), bulk molding compound (BMC), hand lay-up and spray-up, castings, injection molding, resin transfer molding (RTM), reaction injection molding (RIM), centrifugal casting, and filament winding


-In diverse applications Isophthalic Acid:
Isophthalic Acid provides a chemical platform for making thermal and oxidative stable aramid fibers, polyester elastomers, oil additives, adhesives, X-ray contrast agents, and fiber dye enhancers


-Unsaturated Polyester:
Isophthalic Acid type unsaturated resin is the polycondensation of isophthalic acid, butanediol anhydride, and ethylene glycol.
Isophthalic Acid has better hydrolytic stability, higher hardness, and higher hardness than the phthalic acid type unsaturated resin.
Isophthalic Acid mixed with high-performance paper materials can be made into flame-retardant resins and structural resins with good physical properties and low cost, which are used in the manufacture of elevators, handrails, and fishing rods.


-Modified Monomer for Cationic Dyeable Resin:
Isophthalic acid can produce dimethyl isophthalate-5-sodium sulfonate (SIPM), which is a modified monomer for polyester chips.
SIPM can make the modified polyester fiber dyed more bright and dense.
The introduction of SIPM into polyester chips can produce cationic modified polyester filaments.

Although its appearance is not much different from ordinary polyester filaments, the use of cationic modification not only greatly improves the color absorption performance of the fiber, but also reduces the degree of crystallinity.
As a result, the dyeing molecules are easy to penetrate, which makes the fiber easy to color.

This kind of fiber not only ensures cationic dyeability, but also increases the micropores of the fiber, improves the dye uptake, air permeability, and moisture absorption of the fiber, thereby further adapting to the artificial utilization of polyester fiber.
Silky simulation can make the fabric soft, breathable, comfortable, antistatic, co-dyed with wool at room temperature and pressure.



FEATURES OF ISOPHTHALIC ACID:
Isophthalic Acid is a colorless crystalline solid, which can cause eye and skin irritation.
Other features of Isophthalic Acid include stain resistance, corrosion resistance and high thermal stability on coatings industry.



PHYSICAL AND CHEMICAL PROPERTIES OF ISOPHTHALIC ACID:
*Traits by water or ethanol crystals are colorless crystals.
*melting point 345~348 ℃
*relative density 1.507
*solubility: slightly soluble in water, insoluble in benzene, toluene and petroleum ether, soluble in methanol, ethanol, acetone and glacial acetic acid.



PRODUCTION OF ISOPHTHALIC ACID:
Isophthalic Acid is produced by oxidizing meta-xylene using oxygen.
The process employs a cobalt-manganese catalyst.
Purified Isophthalic acid is a colorless crystalline solid with a purity of >99.8%.



ISOPHTHALIC ACID - PREPARATION METHOD:
one-step oxidation method is a commonly used method, which uses M-xylene in acetic acid solvent, cobalt acetate as catalyst, acetaldehyde as promoter, low temperature (120 ℃), low pressure (0. 6MPa) liquid phase oxidation of isophthalic acid and terephthalic acid mixture, after separation and purification of pure isophthalic acid.

Isophthalonitrile hydrolysis method isophthalonitrile as a raw material, obtained by hydrolysis, acidification.
Isophthalic acid - Introduction Heat to above 325 ℃ sublimate without melting.

Isophthalic Acid is easily soluble in methanol, ethanol, acetone and glacial acetic acid, slightly soluble in boiling water, almost insoluble in benzene, toluene and petroleum ether.
Isophthalic Acid is solubility in water: 0.01g/100ml (25 C)



CHEMICAL PROPERTIES OF ISOPHTHALIC ACID:
Isophthalic Acid is a white crystalline powder or needle-like crystals and it’s an isomer of phthalic acid and terephthalic acid.
Isophthalic Acid is insoluble in cold water but soluble in oxygenated solvents and alcohol.
Isophthalic Acid is combustible and finely dispersed particles will form explosive mixtures in air.



PREPARATION OF ISOPHTHALIC ACID:
Isophthalic Acid is produced on the billion kilogram per year scale by oxidizing meta-xylene using oxygen.
The process employs a cobalt-manganese catalyst.
In the laboratory, chromic acid can be used as the oxidant.

It also arises by fusing potassium meta-sulfobenzoate, or meta-bromobenzoate with potassium formate (terephthalic acid is also formed in the last case).
The barium salt, as its hexahydrate, is very soluble in water (a distinction between phthalic and terephthalic acids).
Uvitic acid, 5-methylisophthalic acid, is obtained by oxidizing mesitylene or by condensing pyroracemic acid with baryta water.



REACTIVITY PROFILE OF ISOPHTHALIC ACID:
Isophthalic Acid is a carboxylic acid.
Carboxylic acids donate hydrogen ions if a base is present to accept them.
They react in this way with all bases, both organic (for example, the amines) and inorganic.

Their reactions with bases, called "neutralizations", are accompanied by the evolution of substantial amounts of heat.
Neutralization between an acid and a base produces water plus a salt.
Carboxylic acids with six or fewer carbon atoms are freely or moderately soluble in water; those with more than six carbons are slightly soluble in water.

Soluble carboxylic acid dissociate to an extent in water to yield hydrogen ions.
The pH of solutions of carboxylic acids is therefore less than 7.0.
Many insoluble carboxylic acids react rapidly with aqueous solutions containing a chemical base and dissolve as the neutralization generates a soluble salt.

Carboxylic acids in aqueous solution and liquid or molten carboxylic acids can react with active metals to form gaseous hydrogen and a metal salt.
Such reactions occur in principle for solid carboxylic acids as well, but are slow if the solid acid remains dry.
Even "insoluble" carboxylic acids may absorb enough water from the air and dissolve sufficiently in Isophthalic Acid to corrode or dissolve iron, steel, and aluminum parts and containers.

Carboxylic acids, like other acids, react with cyanide salts to generate gaseous hydrogen cyanide.
The reaction is slower for dry, solid carboxylic acids.
Insoluble carboxylic acids react with solutions of cyanides to cause the release of gaseous hydrogen cyanide.

Flammable and/or toxic gases and heat are generated by the reaction of carboxylic acids with diazo compounds, dithiocarbamates, isocyanates, mercaptans, nitrides, and sulfides.
Carboxylic acids, especially in aqueous solution, also react with sulfites, nitrites, thiosulfates (to give H2S and SO3), dithionites (SO2), to generate flammable and/or toxic gases and heat.

Their reaction with carbonates and bicarbonates generates a harmless gas (carbon dioxide) but still heat.
Like other organic compounds, carboxylic acids can be oxidized by strong oxidizing agents and reduced by strong reducing agents.
These reactions generate heat.

A wide variety of products is possible.
Like other acids, carboxylic acids may initiate polymerization reactions; like other acids, they often catalyze (increase the rate of) chemical reactions.



WHAT IS THE DIFFERENCE BETWEEN ISOPHTHALIC ACID AND TEREPHTHALIC ACID?
The key difference between Isophthalic Acid and terephthalic acid is that isophthalic acid has two carboxylic acid groups separated from one carbon atom.
Whereas, terephthalic acid has its two carboxylic acid groups separated from two carbon atoms.
Furthermore, Isophthalic Acid is an aromatic organic compound having the chemical formula C6H4(CO2H)2 and meta conformation, while terephthalic acid is an aromatic organic compound having the chemical formula C6H4(CO2H)2 and para conformation.



PHYSICAL and CHEMICAL PROPERTIES of ISOPHTHALIC ACID:
Chemical formula: C8H6O4
Molar mass: 166.132 g·mol−1
Appearance: White crystalline solid
Density: 1.526 g/cm3, Solid
Solubility in water: Insoluble
Acidity (pKa): 3.46, 4.46
Magnetic susceptibility (χ): -84.64·10−6 cm3/mol
CAS Number: 121-91-5
Molecular Weight: 166.13
Beilstein: 1909332
EC Number: 204-506-4
MDL number: MFCD00002516
Molecular Weight: 166.13 g/mol
XLogP3: 1.7
Hydrogen Bond Donor Count: 2
Hydrogen Bond Acceptor Count: 4
Rotatable Bond Count: 2
Exact Mass: 166.02660867 g/mol
Monoisotopic Mass: 166.02660867 g/mol
Topological Polar Surface Area: 74.6Ų

Heavy Atom Count: 12
Formal Charge: 0
Complexity: 179
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes
Melting Point: 341.0°C to 343.0°C
Color: White
Infrared Spectrum: Authentic
Assay Percent Range: 99%
Linear Formula: C6H4(CO2H)2
Beilstein: 09, 832
Merck Index: 15, 5243
Solubility Information:
Solubility in water: 0.01g/100mL (25 c).

Other solubilities: freely soluble in alcohol and glacial acetic acid,
practically insoluble in benzene and petroleum,ether
Formula Weight: 166.13
Percent Purity: 99%
Physical Form: Crystalline Powder
Chemical Name or Material: Isophthalic acid
Appearance: white solid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Soluble in: water, 130 mg/L @ 25 °C (exp)
Physical state: powder
Color: beige
Odor: No data available
Melting point/freezing point:
Melting point/range: 341 - 343 °C - lit.
Initial boiling point and boiling range: No data available
Flammability (solid, gas): The product is not flammable.
Upper/lower flammability or explosive limits: No data available
Flash point: No data available
Autoignition temperature: No data available
Decomposition temperature: No data available

pH: No data available
Viscosity
Viscosity, kinematic: No data available
Viscosity, dynamic: No data available
Water solubility: ca.0,12 g/l at 25 °C - soluble
Partition coefficient: n-octanol/water:
log Pow: 0,005 at 22 °C
Vapor pressure: No data available
Density: 1,53 g/cm3 at 25 °C
Relative density: No data available
Relative vapor density: No data available
Particle characteristics: No data available
Explosive properties: No data available
Oxidizing properties: No data available
Other safety information: No data available
Melting Point: 344°C to 348°C (sublimation)
Density: 1.54
Beilstein: 1909332
Merck Index: 14,5197
Solubility Information: Insoluble in water.
Formula Weight: 166.13
Percent Purity: 99%

Chemical Name or Material: Isophthalic acid
Molecular Formula: C8H6O4
Molar Mass: 166.13
Density: 1,54 g/cm3
Melting Point: 341-343 °C (lit.)
Boling Point: 214.32°C (rough estimate)
Flash Poin: 217.281°C
Water Solubility: 0.01 g/100 mL (25 ºC)
Solubility: 0.12g/l
Vapor Presure: 0 Pa at 25℃
Appearance: Colorless crystal
Color: White to off-white
Merck: 14,5197
BRN: 1909332
pKa: 3.54(at 25℃)
PH: 3.33(1 mM solution);2.76(10 mM solution);2.24(100 mM solution)
Storage Condition: Sealed in dry,Room Temperature
Stability: Stable.
Incompatible with strong oxidizing agents, strong bases.
Sensitive: Easily absorbing moisture

Refractive Index: 1.5100 (estimate)
MDL: MFCD00002516
Melting point: 341-343 °C (lit.)
Boiling point: 214.32°C (rough estimate)
Density: 1,54 g/cm3
vapor pressure: 0 Pa at 25℃
refractive index: 1.5100 (estimate)
storage temp.: Sealed in dry,Room Temperature
solubility: 0.12g/l
for: Crystalline Powder
pka: 3.54(at 25℃)
color: White to off-white
PH: 3.33(1 mM solution);2.76(10 mM solution);2.24(100 mM solution)
Water Solubility: 0.01 g/100 mL (25 ºC)
Merck: 14,5197
BRN: 1909332
Stability: Stable.
Incompatible with strong oxidizing agents, strong bases.
InChIKey: QQVIHTHCMHWDBS-UHFFFAOYSA-N
LogP: 1.66 at 25℃



FIRST AID MEASURES of ISOPHTHALIC ACID:
-Description of first-aid measures:
*If inhaled:
If breathed in, move person into fresh air.
*In case of skin contact:
Wash off with soap and plenty of water.
*In case of eye contact:
Flush eyes with water as a precaution.
*If swallowed:
Rinse mouth with water.
-Indication of any immediate medical attention and special treatment needed:
No data available



ACCIDENTAL RELEASE MEASURES of ISOPHTHALIC ACID:
-Environmental precautions:
No special environmental precautions required.
-Methods and materials for containment and cleaning up:
Sweep up and shovel.
Keep in suitable, closed containers for disposal.



FIRE FIGHTING MEASURES of ISOPHTHALIC ACID:
-Extinguishing media:
*Suitable extinguishing media:
Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide.
-Further information:
No data available



EXPOSURE CONTROLS/PERSONAL PROTECTION of ISOPHTHALIC ACID:
-Exposure controls/personal protection:
--Control parameters:
-Ingredients with workplace control parameters:
--Exposure controls:
---Personal protective equipment:
*Eye/face protection:
Use equipment for eye protection.
*Skin protection:
Handle with gloves.
Wash and dry hands.
*Body Protection:
Choose body protection in relation to its type
*Respiratory protection:
Respiratory protection is not required.
-Control of environmental exposure:
No special environmental precautions required



HANDLING and STORAGE of ISOPHTHALIC ACID:
-Precautions for safe handling:
*Hygiene measures:
General industrial hygiene practice.
-Conditions for safe storage, including any incompatibilities:
*Storage conditions:
Store in cool place.
Keep container tightly closed in a dry and well-ventilated place.
*Storage class:
Storage class (TRGS 510): 13: Non Combustible Solids



STABILITY and REACTIVITY of ISOPHTHALIC ACID:
-Reactivity:
No data available
-Chemical stability:
Stable under recommended storage conditions.
-Possibility of hazardous reactions:
No data available
-Conditions to avoid:
No data available



SYNONYMS:
Benzene-1,3-dicarboxylic acid
Isophthalic acid
meta-Phthalic acid
ISOPHTHALIC ACID
121-91-5
Benzene-1,3-dicarboxylic acid
m-Phthalic acid
1,3-Benzenedicarboxylic acid
m-Benzenedicarboxylic acid
Acide isophtalique
Kyselina isoftalova
m-Dicarboxybenzene
NSC 15310
HSDB 2090
EINECS 204-506-4
meta-benzenedicarboxylic acid
UNII-X35216H9FJ
BRN 1909332
CCRIS 8899
CHEBI:30802
AI3-16107
X35216H9FJ
NSC-15310
ISOTEREPHTHALIC ACID
M-CARBOXYBENZOIC ACID
3-CARBOXYBENZOIC ACID
DTXSID3021485
EC 204-506-4
4-09-00-03292 (Beilstein Handbook Reference)
DTXCID301485
WLN: QVR CVQ
MLS001075180
iso-phthalic acid
3-Carboxybenzoic acid
Isoterephthalic acid
NSC 15310
m-Benzenedicarboxylic acid
CAS-121-91-5
NSC15310
NCGC00164010-01
SMR000112097
isopthalic acid
MFCD00002516
1,3-dicarboxybenzene
Isophthalic acid, 99%
benzene-1,3-dioic acid
55185-18-7
Isophthalic acid pound PIA)
SCHEMBL22462
ISOPHTHALIC ACID [MI]
1,3-benzene dicarboxylic acid
Benzene,1,3-dicarboxylic acid
ISOPHTHALIC ACID [HSDB]
ISOPHTHALIC ACID [INCI]
CHEMBL1871181
HMS2269O09
AMY30288
Tox21_200409
Tox21_300106
BBL011591
Isophthalic acid, analytical standard
STL163327
AKOS000119766
DS-6425
NCGC00164010-02
NCGC00164010-03
NCGC00254219-01
NCGC00257963-01
BP-21126
CS-0020265
FT-0627450
FT-0693429
I0155
EN300-19753
A23846
C22203
Q415253
J-004707
J-521560
Z104475158
26776-13-6
8G0
InChI=1/C8H6O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)(H,11,12)
1,3-Benzenedicarboxylic acid
m-Benzenedicarboxylic acid
m-Phthalic acid
Benzene,1,3-dicarboxylic acid
Acide isophtalique
Kyselina isoftalova
IPA
m-Dicarboxybenzene
NSC 15310
Benzene-1,3-dicarboxylic acid
IPA
Isophthalate
m-Benzenedicarboxylic acid
m-Phthalic acid
1,3-Benzenedicarboxylic acid
M-PHTHALIC ACID
m-Phthalic acid
Isophthalic acid
1,3-phthalicacid
m-Dicarboxybenzene
RARECHEM AL BO 0036
1,3-dicarboxybenzene
benzene-1,3-dicarboxylate
m-benzenedicarboxylicacid
1,3-PHENYL DICARBOXYLIC ACID
1,3-BENZENEDICARBOXYLIC ACID
Benzene-1,3-dicarboxylic acid
1,3-BENZENEDICARBOXYLIC ACID
Isophthalic
isophthalate
M-PHTHALIC ACID
1,3-phthalicacid
1,3-dicarboxybenzene
IPA)Isophthalic
sophthalic acid
ISOPHTHALIC ACID
META-PHTHALICACID

ISOPROPANOL Isopropyl Alcohol Isopropanol (izopropil alkol, Isopropanol, IPA) is an organic compound, an isomer of n-propanol, aliased dimethylmethanol, 2-propanol. Isopropanol (izopropil alkol, Isopropanol, IPA) is a colorless, transparent liquid with a scent like a mixture of ethanol and acetone. Soluble in water, also soluble in most organic solvents such as alcohol, ether, benzene, chloroform, etc. Isopropanol (izopropil alkol, Isopropanol, IPA) has a wide range of uses as an organic raw material and solvent. 1）As a chemical raw material, it can produce acetone, hydrogen peroxide, methyl isobutyl ketone, diisobutyl ketone, isopropylamine, diisopropyl ether, isopropyl chloride, and fatty acid isopropyl ester and chloro fatty acid isopropyl ester. 2）In the fine chemical industry, it can be used to produce isopropyl nitrate, isopropyl xanthate, triisopropyl phosphite, aluminum isopropoxide, pharmaceuticals and pesticides, etc. It can also be used to produce diisopropanone, isopropyl acetate and Thymol and gasoline additives. 3）Isopropanol (izopropil alkol, Isopropanol, IPA) Can be used to produce coatings, inks, extractants, aerosols, etc. 4) In the electronics industry, Isopropanol (izopropil alkol, Isopropanol, IPA) can be used as a cleaning and degreasing agent. 5) In the oil and fat industry, the extractant of cottonseed oil can also be used for degreasing of animal-derived tissue membranes. Isopropanol (izopropil alkol, Isopropanol, IPA) (IUPAC name propan-2-ol; commonly called isopropanol or 2-propanol) is a colorless, flammable chemical compound (chemical formula CH3CHOHCH3) with a strong odor.[8] As an isopropyl group linked to a hydroxyl group, it is the simplest example of a secondary alcohol, where the alcohol carbon atom is attached to two other carbon atoms. It is a structural isomer of 1-propanol and ethyl methyl ether. Isopropanol (izopropil alkol, Isopropanol, IPA) is used in the manufacture of a wide variety of industrial and household chemicals and is a common ingredient in chemicals such as antiseptics, disinfectants, and detergents. Names of Isopropanol (izopropil alkol, Isopropanol, IPA) Isopropanol (izopropil alkol, Isopropanol, IPA) Isopropanol (izopropil alkol, Isopropanol, IPA) is also known as 2-propanol, sec-propyl alcohol, IPA, or isopropanol. IUPAC considers isopropanol an incorrect name as the hydrocarbon isopropane does not exist. Properties of Isopropanol (izopropil alkol, Isopropanol, IPA) Isopropanol (izopropil alkol, Isopropanol, IPA) is miscible in water, ethanol, ether, and chloroform. It dissolves ethyl cellulose, polyvinyl butyral, many oils, alkaloids, gums and natural resins.[9] Unlike ethanol or methanol, Isopropanol (izopropil alkol, Isopropanol, IPA) is not miscible with salt solutions and can be separated from aqueous solutions by adding a salt such as sodium chloride. The process is colloquially called salting out, and causes concentrated Isopropanol (izopropil alkol, Isopropanol, IPA) to separate into a distinct layer. Isopropanol (izopropil alkol, Isopropanol, IPA) forms an azeotrope with water, which gives a boiling point of 80.37 °C (176.67 °F) and a composition of 87.7 wt% (91 vol%) Isopropanol (izopropil alkol, Isopropanol, IPA). Water-Isopropanol (izopropil alkol, Isopropanol, IPA) mixtures have depressed melting points.[10] It has a slightly bitter taste, and is not safe to drink. Isopropanol (izopropil alkol, Isopropanol, IPA) becomes increasingly viscous with decreasing temperature and freezes at -89 °C (-128 °F). Isopropanol (izopropil alkol, Isopropanol, IPA) has a maximal absorbance at 205 nm in an ultraviolet-visible spectrum. Reactions of Isopropanol (izopropil alkol, Isopropanol, IPA) Isopropanol (izopropil alkol, Isopropanol, IPA) can be oxidized to acetone, which is the corresponding ketone. This can be achieved using oxidizing agents such as chromic acid, or by dehydrogenation of Isopropanol (izopropil alkol, Isopropanol, IPA) over a heated copper catalyst: (CH3)2CHOH → (CH3)2CO + H2 Isopropanol (izopropil alkol, Isopropanol, IPA) is often used as both solvent and hydride source in the Meerwein-Ponndorf-Verley reduction and other transfer hydrogenation reactions. Isopropanol (izopropil alkol, Isopropanol, IPA) may be converted to 2-bromopropane using phosphorus tribromide, or dehydrated to propene by heating with sulfuric acid. Like most alcohols, Isopropanol (izopropil alkol, Isopropanol, IPA) reacts with active metals such as potassium to form alkoxides that can be called isopropoxides. The reaction with aluminium (initiated by a trace of mercury) is used to prepare the catalyst aluminium isopropoxide.[14] History of Isopropanol (izopropil alkol, Isopropanol, IPA) In 1920, Standard Oil first produced Isopropanol (izopropil alkol, Isopropanol, IPA) by hydrating propene. Its major use at the time was not rubbing alcohol but for oxidation to acetone, whose first major use was in World War I for the preparation of cordite, a smokeless, low explosive propellant. Production of Isopropanol (izopropil alkol, Isopropanol, IPA) In 1994, 1.5 million tonnes of Isopropanol (izopropil alkol, Isopropanol, IPA) were produced in the United States, Europe, and Japan.[16] It is primarily produced by combining water and propene in a hydration reaction or by hydrogenating acetone. There are two routes for the hydration process and both processes require that the Isopropanol (izopropil alkol, Isopropanol, IPA) be separated from water and other by-products by distillation. Isopropanol (izopropil alkol, Isopropanol, IPA) and water form an azeotrope, and simple distillation gives a material that is 87.9% by weight Isopropanol (izopropil alkol, Isopropanol, IPA) and 12.1% by weight water.[18] Pure (anhydrous) Isopropanol (izopropil alkol, Isopropanol, IPA) is made by azeotropic distillation of the wet Isopropanol (izopropil alkol, Isopropanol, IPA) using either diisopropyl ether or cyclohexane as azeotroping agents.[16] Biological of Isopropanol (izopropil alkol, Isopropanol, IPA) Small amounts of Isopropanol (izopropil alkol, Isopropanol, IPA) are produced in the body in diabetic ketoacidosis.[19] Indirect hydration of Isopropanol (izopropil alkol, Isopropanol, IPA) Indirect hydration reacts propene with sulfuric acid to form a mixture of sulfate esters. This process can use low-quality propene, and is predominant in the USA. These processes give primarily Isopropanol (izopropil alkol, Isopropanol, IPA) rather than 1-propanol, because adding water or sulfuric acid to propene follows Markovnikov's rule. Subsequent hydrolysis of these esters by steam produces Isopropanol (izopropil alkol, Isopropanol, IPA), by distillation. Diisopropyl ether is a significant by-product of this process; it is recycled back to the process and hydrolyzed to give the desired product. CH3CH=CH2 + H2O H2SO4⟶ (CH3)2CHOH Direct hydration of Isopropanol (izopropil alkol, Isopropanol, IPA) See also: Heteropoly acid Direct hydration reacts propene and water, either in gas or liquid phase, at high pressures in the presence of solid or supported acidic catalysts. This type of process usually requires higher-purity propylene (> 90%).[16] Direct hydration is more commonly used in Europe. Hydrogenation of acetone Isopropanol (izopropil alkol, Isopropanol, IPA) may be prepared via the hydrogenation of acetone, however this approach involves an extra step compared to the above methods, as acetone is itself normally prepared from propene via the cumene process.[16] It may remain economical depending on the value of the products. A known issue is the formation of MIBK and other self-condensation products. Raney nickel was one of the original industrial catalysts, modern catalysts are often supported bimetallic materials. This is an efficient process and easy Uses of Isopropanol (izopropil alkol, Isopropanol, IPA) One of the small scale uses of isopropanol is in cloud chambers. Isopropanol has ideal physical and chemical properties to form a supersaturated layer of vapor which can be condensed by particles of radiation. In 1990, 45,000 metric tonnes of Isopropanol (izopropil alkol, Isopropanol, IPA) were used in the United States, mostly as a solvent for coatings or for industrial processes. In that year, 5400 metric tonnes were used for household purposes and in personal care products. Isopropanol (izopropil alkol, Isopropanol, IPA) is popular in particular for pharmaceutical applications,[16] due to its low toxicity. Some Isopropanol (izopropil alkol, Isopropanol, IPA) is used as a chemical intermediate. Isopropanol (izopropil alkol, Isopropanol, IPA) may be converted to acetone, but the cumene process is more significant. [16] Solvent of Isopropanol (izopropil alkol, Isopropanol, IPA) Isopropanol (izopropil alkol, Isopropanol, IPA) dissolves a wide range of non-polar compounds. It also evaporates quickly, leaves nearly zero oil traces, compared to ethanol, and is relatively non-toxic, compared to alternative solvents. Thus, it is used widely as a solvent and as a cleaning fluid, especially for dissolving oils. Together with ethanol, n-butanol, and methanol, it belongs to the group of alcohol solvents, about 6.4 million tonnes of which were used worldwide in 2011.[20] Isopropanol (izopropil alkol, Isopropanol, IPA) is commonly used for cleaning eyeglasses, electrical contacts, audio or video tape heads, DVD and other optical disc lenses, removing thermal paste from heatsinks on CPUs and other IC packages, etc. Intermediate Isopropanol (izopropil alkol, Isopropanol, IPA) is esterified to give isopropyl acetate, another solvent. It reacts with carbon disulfide and sodium hydroxide to give sodium isopropylxanthate, a herbicide and an ore flotation reagent.[21] Isopropanol (izopropil alkol, Isopropanol, IPA) reacts with titanium tetrachloride and aluminium metal to give titanium and aluminium isopropoxides, respectively, the former a catalyst, and the latter a chemical reagent.[16] This compound may serve as a chemical reagent in itself, by acting as a dihydrogen donor in transfer hydrogenation. Medical of Isopropanol (izopropil alkol, Isopropanol, IPA) Rubbing alcohol, hand sanitizer, and disinfecting pads typically contain a 60-70% solution of Isopropanol (izopropil alkol, Isopropanol, IPA) or ethanol in water. Water is required to open up membrane pores of bacteria, which acts as a gateway for Isopropanol (izopropil alkol, Isopropanol, IPA). A 75% v/v solution in water may be used as a hand sanitizer.[22] Isopropanol (izopropil alkol, Isopropanol, IPA) is used as a water-drying aid for the prevention of otitis externa, better known as swimmer's ear.[23] Early uses as an anesthetic Although Isopropanol (izopropil alkol, Isopropanol, IPA) can be used for anesthesia, its many negative attributes or drawbacks prohibit this use. Isopropanol (izopropil alkol, Isopropanol, IPA) can also be used similarly to ether as a solvent[24] or as an anesthetic by inhaling the fumes or orally. Early uses included using the solvent as general anesthetic for small mammals[25] and rodents by scientists and some veterinarians. However, it was soon discontinued, as many complications arose, including respiratory irritation, internal bleeding, and visual and hearing problems. In rare cases, respiratory failure leading to death in animals was observed. Automotive Isopropanol (izopropil alkol, Isopropanol, IPA) is a major ingredient in "gas dryer" fuel additives. In significant quantities, water is a problem in fuel tanks, as it separates from gasoline and can freeze in the supply lines at low temperatures. Alcohol does not remove water from gasoline, but the alcohol solubilizes water in gasoline. Once soluble, water does not pose the same risk as insoluble water, as it no longer accumulates in the supply lines and freezes but is consumed with the fuel itself. Isopropanol (izopropil alkol, Isopropanol, IPA) is often sold in aerosol cans as a windshield or door lock deicer. Isopropanol (izopropil alkol, Isopropanol, IPA) is also used to remove brake fluid traces from hydraulic braking systems, so that the brake fluid (usually DOT 3, DOT 4, or mineral oil) does not contaminate the brake pads and cause poor braking. Mixtures of Isopropanol (izopropil alkol, Isopropanol, IPA) and water are also commonly used in homemade windshield washer fluid. Laboratory As a biological specimen preservative, Isopropanol (izopropil alkol, Isopropanol, IPA) provides a comparatively non-toxic alternative to formaldehyde and other synthetic preservatives. Isopropanol (izopropil alkol, Isopropanol, IPA) solutions of 70-99% are used to preserve specimens. Isopropanol (izopropil alkol, Isopropanol, IPA) is often used in DNA extraction. A lab worker adds it to a DNA solution to precipitate the DNA, which then forms a pellet after centrifugation. This is possible because DNA is insoluble in Isopropanol (izopropil alkol, Isopropanol, IPA). Safety of Isopropanol (izopropil alkol, Isopropanol, IPA) Isopropanol (izopropil alkol, Isopropanol, IPA) vapor is denser than air and is flammable, with a flammability range of between 2 and 12.7% in air. It should be kept away from heat and open flame.[26] Distillation of Isopropanol (izopropil alkol, Isopropanol, IPA) over magnesium has been reported to form peroxides, which may explode upon concentration. Isopropanol (izopropil alkol, Isopropanol, IPA) is a skin irritant. Wearing protective gloves is recommended. Toxicology of Isopropanol (izopropil alkol, Isopropanol, IPA) Isopropanol (izopropil alkol, Isopropanol, IPA) and its metabolite, acetone, act as central nervous system (CNS) depressants.[31] Poisoning can occur from ingestion, inhalation, or skin absorption. Symptoms of Isopropanol (izopropil alkol, Isopropanol, IPA) poisoning include flushing, headache, dizziness, CNS depression, nausea, vomiting, anesthesia, hypothermia, low blood pressure, shock, respiratory depression, and coma.[31] Overdoses may cause a fruity odor on the breath as a result of its metabolism to acetone.[32] Isopropanol (izopropil alkol, Isopropanol, IPA) does not cause an anion gap acidosis but it produces an osmolal gap between the calculated and measured osmolalities of serum, as do the other alcohols.[31] Isopropanol (izopropil alkol, Isopropanol, IPA) is oxidized to form acetone by alcohol dehydrogenase in the liver,[31] and has a biological half-life in humans between 2.5 and 8.0 hours.[31] Unlike methanol or ethylene glycol poisoning, the metabolites of Isopropanol (izopropil alkol, Isopropanol, IPA) are considerably less toxic, and treatment is largely supportive. Furthermore, there is no indication for the use of fomepizole, an alcohol dehydrogenase inhibitor, unless co-ingestion with methanol or ethylene glycol is suspected. In forensic pathology, people who have died as a result of diabetic ketoacidosis usually have blood concentrations of Isopropanol (izopropil alkol, Isopropanol, IPA) of tens of mg/dL, while those by fatal Isopropanol (izopropil alkol, Isopropanol, IPA) ingestion usually have blood concentrations of hundreds of mg/dL. Isopropanol (izopropil alkol, Isopropanol, IPA) will attack some forms of plastics, rubber, and coatings. Isopropanol (izopropil alkol, Isopropanol, IPA) is an isomer of propyl alcohol with antibacterial properties. Although the exact mechanism of isopropanol's disinfecting action is not known, it might kill cells by denaturing cell proteins and DNA, interfering with cellular metabolism, and dissolving cell lipo-protein membranes. Isopropanol is used in soaps and lotions as an antiseptic. Any clothing which becomes wet with liquid Isopropanol (izopropil alkol, Isopropanol, IPA) should be removed immediately and not reworn until the Isopropanol (izopropil alkol, Isopropanol, IPA) is removed from the clothing. Clothing should then be placed in closed containers for storage until it can be discarded or until provision can be made for the removal of Isopropanol (izopropil alkol, Isopropanol, IPA) from the clothing. If the clothing is to be laundered or otherwise cleaned to remove the Isopropanol (izopropil alkol, Isopropanol, IPA), the person performing the operation should be informed of Isopropanol (izopropil alkol, Isopropanol, IPA)'s hazardous properties. When a stream of hydrogen entrained Isopropanol (izopropil alkol, Isopropanol, IPA) vapors and palladium particles, the mixture caught fire on exposure to air. Solutions of 90% nitroform in 10% Isopropanol (izopropil alkol, Isopropanol, IPA) in polyethylene bottles exploded. The reaction between Isopropanol (izopropil alkol, Isopropanol, IPA) and phosgene forms isopropyl chloroformate and hydrogen chloride. In the presence of iron salts thermal decomposition can occur, which in some cases can become explosive. Mixing oleum and Isopropanol (izopropil alkol, Isopropanol, IPA) in a closed container caused the temperature and pressure to increase. Isopropanol (izopropil alkol, Isopropanol, IPA) (without residue) may be used in inks for marking food supplements in tablet form, gum, and confectionery. Isopropanol (izopropil alkol, Isopropanol, IPA) may be present in the following foods under the conditions specified: (a) In spice oleoresins as a residue from the extraction of spice, at a level not to exceed 50 parts per million. (b) In lemon oil as a residue in production of the oil, at a level not to exceed 6 parts per million. (c) In hops extract as a residue from the extraction of hops at a level not to exceed 2.0 percent by weight: Provided, that, (1) The hops extract is added to the wort before or during cooking in the manufacture of beer. (2) The label of the hops extract specifies the presence of the Isopropanol (izopropil alkol, Isopropanol, IPA) and provides for the use of the hops extract only as prescribed by paragraph (c)(1) of this section. WORKERS IN AN Isopropanol (izopropil alkol, Isopropanol, IPA) PACKAGING PLANT BECAME ILL AFTER ACCIDENTAL EXPOSURE TO CARBON TETRACHLORIDE. Isopropanol (izopropil alkol, Isopropanol, IPA) POTENTIATION OF CARBON TETRACHLORIDE TOXICITY HAS BEEN SHOWN PREVIOUSLY ONLY IN RATS. ACETONE, A PRODUCT OF Isopropanol (izopropil alkol, Isopropanol, IPA) METABOLISM, IS A MAJOR POTENTIATOR OF CARBON TETRACHLORIDE TOXICITY. IDENTIFICATION: Isopropanol (izopropil alkol, Isopropanol, IPA) is an aliphatic alcohol hydrocarbon. It is prepared from propylene, which is obtained in the cracking of petroleum or by the reduction of acetone. It is a colorless liquid which is soluble in water, alcohol, ether, acetone, benzene and chloroform. It is insoluble in salt solutions. It has a slight odor resembling a mixture of ethanol and acetone and has a slight bitter taste. It is used in antifreeze, industrial solvent, solvent for gums, shellac, essential oils, in quick drying oils, creosote and resins; extraction of alkaloids; in quick drying inks; in denaturing ethyl alcohol; in body rubs, hand lotions, after shave lotions, cosmetics and pharmaceuticals; in manufacture of acetone, glycerol, isopropyl acetate; antiseptic; rubefacient ; and pharmaceutical aid. HUMAN EXPOSURE: Toxic effects include central nervous depression, liver, kidney, cardiovascular depression and brain damage. It can cause drowsiness, ataxia, stupor, coma and respiratory depression, irritation of mucous membranes and eyes, gastritis, gastric hemorrhage, vomiting, pancreatitis, cold clammy skin, hypothermia, miosis, tachycardia, slow and noisy respiration. High risk of circumstances of poisoning: Accidental ingestion of rubbing alcohols/toiletries by children. There is a potential exposure from dermal and inhalation exposure in children during Isopropanol (izopropil alkol, Isopropanol, IPA) sponging for control of fever. Intentional ingestion for alcoholic effect or in suicide attempts. Occupational or accidental exposure to liquid or its vapor in industrial applications. Individuals exposed to Isopropanol (izopropil alkol, Isopropanol, IPA) include the following: workers in the pharmaceutical industry, cosmetic industry, chemical industry, petroleum workers, laboratory workers, printers, painters and carpenters and cabinet makers. There is little absorption through intact skin. Isopropanol (izopropil alkol, Isopropanol, IPA) is a potent eye and skin irritant. 80% of an oral dose is absorbed within 30 minutes. Absorption is complete within 2 hours although this may be delayed in a large overdose. Alveolar concentration is correlated to the environmental concentration at any given time. Isopropanol (izopropil alkol, Isopropanol, IPA) is absorbed through intact skin on prolonged exposure. Isopropanol (izopropil alkol, Isopropanol, IPA) distributes in body water with an apparent volume of distribution of 0.6-0.7 L/kg. 20-50% of an absorbed dose is excreted unchanged. Most Isopropanol (izopropil alkol, Isopropanol, IPA) is oxidized in the liver by alcohol dehydrogenase to acetone, formate and finally carbon dioxide. Acetone is slowly eliminated by the lung (40%) or kidney. Clinically insignificant excretion occurs into the stomach and saliva. Related keto acids are not produced in sufficient quantities to cause a severe metabolic acidosis. Inebriation, peripheral vasodilation has occurred. In children, hypoglycemia is particularly severe when poisoning following fasting, exercise or chronic malnutrition Lactic acidosis may occur in patients with severe liver disease, pancreatitis or receiving biguanide therapy or as a result of the hypovolemia which frequently accompanies severe intoxication. ANIMAL STUDIES: Isopropanol (izopropil alkol, Isopropanol, IPA) most closely follows first order kinetics, with a half life of 2.5 to 3.2 hours. The elimination half life of the active metabolite acetone is significantly prolonged to about 5 hours in rats. In rat hepatocytes the following has been observed: marked depletion of glutathione, increased malondialdehyde production, decreased protein sulfhydryls content and leakage of lactic dehydrogenase with loss of membrane activity. A complete history and physical examination should be performed to detect pre existing conditions that might place the employee at increased risk, and to establish a baseline for future health monitoring. Examination of the skin, liver, kidneys, and respiratory system should be stressed. Skin disease: Isopropanol (izopropil alkol, Isopropanol, IPA) is a defatting agent and can cause dermatitis on prolonged exposure. Persons with pre existing skin disorders may be more susceptible to the effects of this agent. Liver disease: Although Isopropanol (izopropil alkol, Isopropanol, IPA) is not known as a liver toxin in humans, the importance of this organ in the biotransformation and detoxification of foreign substances should be considered before exposing persons with impaired liver function. Kidney disease: Although Isopropanol (izopropil alkol, Isopropanol, IPA) is not known as a kidney toxin in humans, the importance of this organ in the elimination of toxic substances justifies special consideration in those with impaired renal function. Chronic respiratory disease: In persons with impaired pulmonary function, especially those with obstructive airway diseases, the breathing of Isopropanol (izopropil alkol, Isopropanol, IPA) might cause exacerbation of symptoms due to its irritant properties. Periodic Medical Examination: The aforementioned medical examinations should be repeated on an annual basis. The assessment of Isopropanol (izopropil alkol, Isopropanol, IPA) exposure can be accomplished through measurement of either Isopropanol (izopropil alkol, Isopropanol, IPA) or acetone. Isopropanol (izopropil alkol, Isopropanol, IPA) measurement has not been found to be a good assessment of low level exposure, due to its low sensitivity. However, measurement of acetone has been found to be a good indicator of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) exposure for exposures as low as 70 ppm, and has been found to correlate well with air concentrations. Whole Blood Reference Ranges: Normal - none detected (Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)); Exposed - BAT (sampling time is end of exposure or end of shift, measured as the metabolite, acetone), 50 mg/l; Toxic - Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) level associated with serious toxic symptoms is 150 mg/l. Serum or Plasma Reference Ranges: Normal - none detected (Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)); Exposed - not established; and Toxic - not established. Urine Reference Ranges: The assessment of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) exposure can be accomplished through measurement of either Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) or acetone. However only acetone was found to be a useful test, due to its greater sensitivity and good correlation with air exposure levels. Normal - none detected (Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)); Exposed - BAT (sampling time is end of exposure or end of shift, measured as the metabolite, acetone), 50 mg/l; Toxic - Not established. Persons with pre existing skin disorders may be more susceptible to the effects of this agent. ... In persons with impaired pulmonary function, especially those with obstructive airway diseases, the breathing of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) might cause exacerbation of symptoms due to its irritant properties. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)'s production and use in the manufacture of acetone, glycerol, and isopropyl acetate and as a solvent for a variety of applications may result in its release to the environment through various waste streams. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)'s use in hydraulic fracturing fluids results in its direct release to the environment. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) has been identified as a metabolic product of aerobic microorganisms, anaerobic microorganisms, fungi, and yeast. If released to air, a vapor pressure of 45.4 mm Hg at 25 °C indicates Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) will exist solely as a vapor in the ambient atmosphere. Vapor-phase Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) will be degraded in the atmosphere by reaction with photochemically-produced hydroxyl radicals; the half-life for this reaction in air is estimated to be 3.2 days. If released to soil, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is expected to have very high mobility based upon an estimated Koc of 1.5. Volatilization from moist soil surfaces is expected to be an important fate process based upon a Henry's Law constant of 8.10X10-6 atm-cu m/mole. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is expected to volatilize from dry soil surfaces based upon its vapor pressure. If released into water, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is not expected to adsorb to suspended solids and sediment based upon the estimated Koc. Volatilization from water surfaces is expected to be an important fate process based upon this compound's Henry's Law constant. Estimated volatilization half-lives for a model river and model lake are 86 hours and 29 days, respectively. An estimated BCF of 3 suggests the potential for bioconcentration in aquatic organisms is low. Hydrolysis is not expected to occur due to the lack of hydrolyzable functional groups. Biodegradation is expected to be an important fate process based on the results of microbial screening tests. Occupational exposure to Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) may occur through inhalation and dermal contact with this compound at workplaces where Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is produced or used. Monitoring data indicate that the general population may be exposed to Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) via inhalation of ambient air, ingestion of food and drinking water, and dermal contact with this compound directly and from consumer products containing Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA). ANAEROBIC: Typical Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) removal efficiencies for an anaerobic lagoon treatment facility, with a retention time of 15 days, were 50% after loading with dilute waste, and 69 and 74% after loading with concentrated wastes(1). In closed bottle studies, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) was completely degraded anaerobically by an acetate-enriched culture, derived from a seed of domestic sludge(1). The culture started to use cross-fed Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA), after 4 days, at a rate of 200 mg/L/day(1). In a mixed reactor with a 20-day retention time, seeded by the same culture, 56% removal was achieved in the 20 days following 70 days of acclimation to a final concentration of 10,000 mg/L(1). The avg percent removal of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) in semi-pilot scale anaerobic lagoons was 50% in 7.5-10 days for dilute wastes with 60 ppm Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) and 69-74% in 20-40 days for concentrated wastes with 175 ppm Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)(2). Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) was readily mineralized to methane and carbon dioxide under methanogenic conditions(3). The degradation rate of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) under these conditions in fuel impacted river sediments and industrial/sewage impacted creek sediments was 2.4 ppm C/day (82% of expected methane recovery) and 3.0 ppm C/day (91% of expected methane recovery), respectively(3). The degradation rate of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) in a sediment slurry from a shallow anoxic aquifer under methanogenic conditions was 7.6 ppm C/day (112% of theoretical methane recovery)(4). In anaerobic bioreactor studies using a granular sludge inocula, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) (at 125 ppm initial concentration) degraded with 115.5% of theoretical methane production over a 21-day incubation period(5); acetone was identified as a metabolite(5). In laboratory anaerobic sludge reactor tests using liquid hen manure as inoculum, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) was degraded 100% in a 13-day incubation period with lag period(6). The Henry's Law constant for Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is 8.10X10-6 atm-cu m/mole at 25 °C(1). This Henry's Law constant indicates that Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 86 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 29 days(SRC). Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)'s Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 45.2 mm Hg at 25 °C(3). The volatilization of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) from a runoff tank of an industrial wastewater treatment facility was measured; the volatilization rate of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) ranged between 0.64-0.69 mg/sq m-min(4). The evaporation rate of a 1:1 Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA):water mixture from a shallow pool was 1.5 kg/sq-m per hour at a wind speed of 4.5 m/s and pool temperature of 20 °C and an ambient air temperature of 22 °C(5). Laboratory studies demonstrated that Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) will volatilize from water to air in the absence of wind(6).

ISOPROPANOLAMINE, N° CAS : 78-96-6, Nom INCI : ISOPROPANOLAMINE, Nom chimique : 1-Aminopropan-2-ol, N° EINECS/ELINCS : 201-162-7, Régulateur de pH : Stabilise le pH des cosmétiques. Principaux synonymes Noms français : 1-AMINO 2-PROPANOL; 1-AMINO-2-HYDROXYPROPANE; 1-AMINO-2-PROPANOL; 1-AMINOPROPAN-2-OL; 1-METHYL-2-AMINOETHANOL; 2-HYDROXY-1-PROPYLAMINE; 2-HYDROXYPROPANAMINE; 2-HYDROXYPROPYLAMINE; 2-PROPANOL, 1-AMINO-; ALPHA-AMINOISOPROPYL ALCOHOL; AMINO-1 PROPANOL-2; Isopropanolamine; Monoisopropanolamine ; Noms anglais : Isopropanolamine Utilisation et sources d'émission : Fabrication de produits organiques, fabrication de produits pharmaceutiques

isopropyl alcohol; Dimethylcarbinol; sec-Propyl alcohol; Rubbing alcohol; Petrohol; 1-Methylethanol; 1-Methylethyl alcohol; 2-Hydroxypropane; 2-Propyl alcohol; Isopropyl alcohol; Propan-2-ol; IPA; 2-Propanol; Alcool Isopropilico (Italian); Alcool Isopropylique; I-Propanol; I-Propylalkohol; Iso-Propylalkohol cas no: 67-63-0

Isopropyl Acetate (İzopropil Asetat) IUPAC Name propan-2-yl acetate Isopropyl Acetate (İzopropil Asetat) InChI InChI=1S/C5H10O2/c1-4(2)7-5(3)6/h4H,1-3H3 Isopropyl Acetate (İzopropil Asetat) InChI Key JMMWKPVZQRWMSS-UHFFFAOYSA-N Isopropyl Acetate (İzopropil Asetat) Canonical SMILES CC(C)OC(=O)C Isopropyl Acetate (İzopropil Asetat) Molecular Formula C5H10O2 Isopropyl Acetate (İzopropil Asetat) CAS 108-21-4 Isopropyl Acetate (İzopropil Asetat) European Community (EC) Number 203-561-1 Isopropyl Acetate (İzopropil Asetat) ICSC Number 0907 Isopropyl Acetate (İzopropil Asetat) NSC Number 9295 Isopropyl Acetate (İzopropil Asetat) RTECS Number AI4930000 Isopropyl Acetate (İzopropil Asetat) UN Number 1220 Isopropyl Acetate (İzopropil Asetat) UNII 1Y67AFK870 Isopropyl Acetate (İzopropil Asetat) JECFA Number 305 Isopropyl Acetate (İzopropil Asetat) FEMA Number 2926 Isopropyl Acetate (İzopropil Asetat) DSSTox Substance ID DTXSID2025478 Isopropyl Acetate (İzopropil Asetat) Physical Description Isopropyl acetate appears as a clear colorless liquid. Flash point 40°F. Vapors are heavier than air. Contact with the material may irritate skin, eyes or mucous membranes. May be toxic by ingestion, inhalation and skin absorption. Used as a solvent. Isopropyl Acetate (İzopropil Asetat) Color/Form Water-white liquid Isopropyl Acetate (İzopropil Asetat) Odor Aromatic Isopropyl Acetate (İzopropil Asetat) Taste ON DILUTION A SWEET APPLE-LIKE FLAVOR Isopropyl Acetate (İzopropil Asetat) Boiling Point 190 to 196 °F at 743.3 mm Hg Isopropyl Acetate (İzopropil Asetat) Melting Point -100.1 °F Isopropyl Acetate (İzopropil Asetat) Flash Point 36 °F Isopropyl Acetate (İzopropil Asetat) Solubility 1 to 10 mg/mL at 68° F Isopropyl Acetate (İzopropil Asetat) Density 0.874 at 68 °F Isopropyl Acetate (İzopropil Asetat) Vapor Density 3.5 Isopropyl Acetate (İzopropil Asetat) Vapor Pressure 1 mm Hg at -36.9 °F ; 100 mm Hg at 96.3° F; 760 mm Hg at 192.2° F Isopropyl Acetate (İzopropil Asetat) LogP log Kow = 1.02 Isopropyl Acetate (İzopropil Asetat) LogKoa 2.93 Isopropyl Acetate (İzopropil Asetat) Henrys Law Constant 2.78e-04 atm-m3/mole Isopropyl Acetate (İzopropil Asetat) Atmospheric OH Rate Constant 3.40e-12 cm3/molecule*sec Isopropyl Acetate (İzopropil Asetat) Autoignition Temperature 860 °F Isopropyl Acetate (İzopropil Asetat) Viscosity 0.49 CENTIPOISE @ 25 °C Isopropyl Acetate (İzopropil Asetat) Heat of Combustion -9420 Btu/lb= -5230 cal/g= -219X10+3 J/kg Isopropyl Acetate (İzopropil Asetat) Heat of Vaporization 150 Btu/lb= 81 cal/g= 3.4X10+5 J/kg Isopropyl Acetate (İzopropil Asetat) Surface Tension 26 dynes/cm= 0.026 N/m @ 20 °C Isopropyl Acetate (İzopropil Asetat) Ionization Potential 9.95 eV Isopropyl Acetate (İzopropil Asetat) Molecular Weight 102.13 g/mol Isopropyl Acetate (İzopropil Asetat) XLogP3-AA 0.9 Isopropyl Acetate (İzopropil Asetat) Hydrogen Bond Donor Count 0 Isopropyl Acetate (İzopropil Asetat) Hydrogen Bond Acceptor Count 2 Isopropyl Acetate (İzopropil Asetat) Rotatable Bond Count 2 Isopropyl Acetate (İzopropil Asetat) Exact Mass 102.06808 g/mol Isopropyl Acetate (İzopropil Asetat) Monoisotopic Mass 102.06808 g/mol Isopropyl Acetate (İzopropil Asetat) Topological Polar Surface Area 26.3 Ų Isopropyl Acetate (İzopropil Asetat) Heavy Atom Count 7 Isopropyl Acetate (İzopropil Asetat) Formal Charge 0 Isopropyl Acetate (İzopropil Asetat) Complexity 66.5 Isopropyl Acetate (İzopropil Asetat) Isotope Atom Count 0 Isopropyl Acetate (İzopropil Asetat) Defined Atom Stereocenter Count 0 Isopropyl Acetate (İzopropil Asetat) Undefined Atom Stereocenter Count 0 Isopropyl Acetate (İzopropil Asetat) Defined Bond Stereocenter Count 0 Isopropyl Acetate (İzopropil Asetat) Undefined Bond Stereocenter Count 0 Isopropyl Acetate (İzopropil Asetat) Covalently-Bonded Unit Count 1 Isopropyl Acetate (İzopropil Asetat) Compound Is Canonicalized Yes General description Isopropyl acetate is an isopropyl ester of acetic acid. It participates in the mesoporous Al-MCM-41 (Si/Al = 55 and 104) and Al, Zn-MCM-41 (Si/(Al+Zn) = 52) molecular sieves catalyzed alkylation of m-cresol. It is widely used for the incorporation of aroma to various cosmetics and food products. Vapor-liquid equilibria for its binary mixture with CO2 at higher pressures has been evaluated.It is a colorless, flammable liquid, having a pleasant fruity type of odor. Application Isopropyl acetate may be employed as model oxygenate compound to evaluate the catalytic efficiency of La0.8Sr0.2MnO3+x perovskite catalyst for the oxidation of various oxy-derivative compounds.It may be used as extracting reagent for the N,N-dimethyl-2-[5-(cyanomethyl)-1H-indol-3-yl]ethylamine. Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.Isopropyl acetate is an ester, an organic compound which is the product of esterification of acetic acid and isopropanol. It is a clear, colorless liquid with a characteristic fruity odor.Isopropyl acetate is a solvent with a wide variety of manufacturing uses that is miscible with most other organic solvents, and moderately soluble in water. It is used as a solvent for cellulose, plastics, oil and fats. It is a component of some printing inks and perfumes.Isopropyl acetate decomposes slowly on contact with steel in the presence of air, producing acetic acid and isopropanol. It reacts violently with oxidizing materials and it attacks many plastics.Isopropyl acetate is quite flammable in both its liquid and vapor forms, and it may be harmful if swallowed or inhaled.The Occupational Safety and Health Administration has set a permissible exposure limit (PEL) of 250 ppm (950 mg/m3) over an eight-hour time-weighted average for workers handling isopropyl acetate.Isopropyl acetate appears as a clear colorless liquid. Flash point 40°F. Vapors are heavier than air. Contact with the material may irritate skin, eyes or mucous membranes. May be toxic by ingestion, inhalation and skin absorption. Used as a solvent.Isopropyl acetate is found in alcoholic beverages. Isopropyl acetate is isolated from ripening melons, apples, bananas, blackcurrants, other fruits and grape oil. Also present in cheddar cheese, soybean, beer, red wine, white wine and plum brandy. Isopropyl acetate is a flavouring ingredient Isopropyl acetate is a solvent with a wide variety of manufacturing uses that is miscible with most other organic solvents, and moderately soluble in water. It is used as a solvent for cellulose, plastics, oil and fats. It is a component of some printing inks and perfumes. Isopropyl acetate is an ester, an organic compound which is the product of condensation of acetic acid and isopropanol. It is a clear, colorless liquid with a characteristic fruity odor. Application Isopropyl acetate may be employed as a model oxygenate compound to evaluate the catalytic efficiency of La0.8Sr0.2MnO3+x perovskite catalyst for the oxidation of various oxy-derivative compounds.It may be used as an extracting reagent for the N,N-dimethyl-2-[5-(cyanomethyl)-1H-indol-3-yl]ethylamine. Coatings, Cleaning fluids, Printing inks, Cosmetic /personal care solvent,Fragrance solvent Features: Non-HAP (Hazardous air pollutant) Solvent; Good resin solvent; Mild odor; Fast evaporating Substituents: Acetate salt, Carboxylic acid ester, Hydrocarbon derivative, Organooxygen compound, Carbonyl group, Aliphatic acyclic compound Isopropyl acetate is used mainly as a solvent for rotogravure and flexographic printing inks.Other applications include coatings, cleaning fluids, cosmetics, and fragrances.Isopropyl acetate liquid and vapor are flammable. The product is stable at recommended temperatures and pressures. Isopropyl acetate is incompatible with alkali metal hydroxides,such as sodium hydroxide, as well as nitric acid and strong oxidizers, and contact should be avoided.Eye contact with liquid isopropyl acetate may cause severe irritation and severe corneal injury. Eye contact with vapor may cause mild discomfort and redness. Prolonged skin contact may cause slight irritation with local redness and discomfort and possible drying or flaking of the skin. It is unlikely to result in absorption of harmful amounts. Excessive inhalation of isopropyl acetate vapors may cause irritation to the nose, throat, and lungs, as well as central nervous system effects. In confined or poorly ventilated areas,unconsciousness or death could occur. Isopropyl acetate is highly biodegradable, unlikely to bioaccumulate in the food chain, and is practically non-toxic to fish and aquatic organisms.Worker exposure is possible during manufacturing or other industrial processes using isopropyl acetate. Consumers could be exposed by using cosmetics, fragrances, or other products made with it.nt Isopropyl acetate is broadly used as a solvent in commercial printing processes for: Exposure Potential Isopropyl acetate is used in the production of industrial and consumer products. Based on the uses for isopropyl acetate the public could be exposed through: Workplace exposure.Exposure can occur either in an isopropyl acetate manufacturing facility or in the various industrial or manufacturing facilities that use it. Those working with isopropyl acetate in manufacturing operations could be exposed during maintenance, sampling, testing, or other procedures. Each facility should have a thorough training program for employees and appropriate work processes and safety equipment in place to limit unnecessary exposure. Consumer exposure to products containing isopropyl acetate for direct consumer use. Consumers could be exposed to isopropyl acetate by using cosmetics or other products containing it. See Health Information. Isopropyl acetate may be released to air by evaporation from products that contain it. Although the substance is moderately soluble, when introduced to water, it will have a tendency to evaporate. Because the chemical is highly biodegradable, it will be treated by sewage treatment plants. Large release - Industrial spills or releases are infrequent and generally contained. If a large spill does occur, dike the area to contain the spilled material. Isolate the area and evacuate unnecessary personnel. Eliminate all sources of ignition. Ground and bond all containers and handling equipment. In case of fire - Keep people away and prevent unnecessary entry. Isopropyl acetate vapor is an explosion hazard. Vapors are heavier than air and may travel long distances and accumulate in low-lying areas. Wear positive-pressure, self-contained breathing apparatus (SCBA) and protective fire-fighting clothing or fight fire from a safe distance. Use water fog or fine spray, dry-chemical or carbon-dioxide fire extinguishers, or foam. Do not use a direct water stream as it may spread the fire. Follow emergency procedures carefully. Eye and Skin Contact - Eye contact with liquid isopropyl acetate may cause severe irritation and severe corneal injury. Eye contact with vapor may cause mild discomfort and redness. Prolonged skin contact may cause slight irritation with local redness and discomfort and possible drying or flaking of the skin. Prolonged contact is unlikely to result in absorption of harmful amounts. Inhalation - Excessive inhalation of isopropyl acetate vapors may cause irritation to the nose, throat, and lungs, as well as central nervous system effects. In confined or poorly ventilated areas, unconsciousness or death could occur.Ingestion - Isopropyl acetate has very low toxicity if small amounts are swallowed. Cancer and Birth Defect Information - This material did not cause cancer in laboratory animals. In laboratory tests isopropyl acetate has been toxic to the fetus at doses toxic to the mother, but is not expected to interfere with reproduction. This material was negative in in vitro and animal genetic toxicity studies. Isopropyl acetate is moderately volatile, and will evaporate from products that contain it. Although the substance is moderately soluble in water, it will have a tendency to evaporate from it. It has minimal tendency to bind to soil or sediment. Isopropyl acetate is unlikely to persist in the environment. The substance is highly biodegradable, which suggests the chemical will be removed from water and soil environments, including biological wastewater treatment plants. Isopropyl acetate is not likely to accumulate in the food chain (bioconcentration potential is low) and is practically nontoxic to fish and other aquatic organisms on an acute basis. Isopropyl acetate liquid and vapor are flammable. Isopropyl acetate vapors are heavier than air and can travel long distances, posing an explosion hazard. The material is stable at recommended storage and use temperatures. Store away from heat, sparks, and flame. Exposure to elevated temperatures can cause isopropyl acetate to decompose. Isopropyl acetate is incompatible with alkali metal hydroxides, such as sodium hydroxide, as well as nitric acid and strong oxidizers, and contact should be avoided. Regulations may exist that govern the manufacture, sale, transportation, use, and/or disposal of isopropyl acetate. These regulations may vary by city, state, country, or geographic region. HAZARD SUMMARY * Isopropyl Acetate can affect you when breathed in. * Contact can irritate and burn the eyes. * Contact can cause severe skin burns. Repeated exposure can cause dryness and cracking of the skin. * Breathing Isopropyl Acetate can irritate the nose, throat and lungs causing coughing, wheezing and/or shortness of breath. * High exposure can cause headache, drowsiness, poor muscle coordination, unconsciousness and coma. * Isopropyl Acetate may affect the liver. * Isopropyl Acetate is a FLAMMABLE LIQUID and a DANGEROUS FIRE HAZARD. IDENTIFICATION Isopropyl Acetate is a colorless liquid with a fruity odor. It is used as a solvent for cellulose, plastics, oils and fats, and in printing inks and perfume. HOW TO DETERMINE IF YOU ARE BEING EXPOSED The New Jersey Right to Know Act requires most employers to label chemicals in the workplace and requires public employers to provide their employees with information and training concerning chemical hazards and controls. The federal OSHA Hazard Communication Standard, 1910.1200, requires private employers to provide similar training and information to their employees. * Exposure to hazardous substances should be routinely evaluated. This may include collecting personal and area air samples. You can obtain copies of sampling results from your employer. You have a legal right to this information under OSHA 1910.1020. * If you think you are experiencing any work-related health problems, see a doctor trained to recognize occupational diseases. Take this Fact Sheet with you. * ODOR THRESHOLD = 4.1 ppm. * The range of accepted odor threshold values is quite broad. Caution should be used in relying on odor alone as a warning of potentially hazardous exposures. WORKPLACE EXPOSURE LIMITS OSHA: The legal airborne permissible exposure limit (PEL) is 250 ppm averaged over an 8-hour workshift. NIOSH: No exposure limit has been established. ACGIH: The recommended airborne exposure limit is 100 ppm averaged over an 8-hour workshift and 200 ppm as a STEL (short term exposure limit). WAYS OF REDUCING EXPOSURE * Where possible, enclose operations and use local exhaust ventilation at the site of chemical release. If local exhaust ventilation or enclosure is not used, respirators should be worn. * Wear protective work clothing. * Wash thoroughly immediately after exposure to Isopropyl Acetate and at the end of the workshift. * Post hazard and warning information in the work area. In addition, as part of an ongoing education and training effort, communicate all information on the health and safety hazards of Isopropyl acetate to potentially exposed workers. This Fact Sheet is a summary source of information of all potential and most severe health hazards that may result from exposure. Duration of exposure, concentration of the substance and other factors will affect your susceptibility to any of the potential effects described below. HEALTH HAZARD INFORMATION Acute Health Effects The following acute (short-term) health effects may ocur immediately or shortly after exposure to Isopropyl Acetate: * Contact can irritate and burn the eyes. * Contact can cause severe skin burns. * Breathing Isopropyl Acetate can irritate the nose, throat and lungs causing coughing, wheezing and/or shortness of breath. * High exposure can cause headache, drowsiness, poor muscle coordination, unconsciousness and coma. Chronic Health Effects The following chronic (long-term) health effects can occur at some time after exposure to Isopropyl Acetate and can last for months or years: Cancer Hazard * According to the information presently available to the New Jersey Department of Health and Senior Services, Isopropyl Acetate has not been tested for its ability to cause cancer in animals. Reproductive Hazard * According to the information presently available to the New Jersey Department of Health and Senior Services, Isopropyl Acetate has not been tested for its ability to affect reproduction. Other Long-Term Effects * Repeated exposure can cause dryness and cracking of the skin. * Isopropyl Acetate can irritate the lungs. Repeated exposure may cause bronchitis to develop with cough, phlegm, and/or shortness of breath. * Isopropyl Acetate may affect the liver. * This chemical has not been adequately evaluated to determine whether brain or other nerve damage could ocur with repeated exposure. However, many solvents and other petroleum-based chemicals have been shown to cause such damage. Effects may include reduced memory and concentration, personality changes (withdrawal, irritability), fatigue, sleep disturbances, reduced coordination, and/or effects on nerves supplying internal organs (autonomic nerves) and/or nerves to the arms and legs (weakness, "pins and needles"). MEDICAL Medical Testing If symptoms develop or overexposure is suspected, the following are recommended: * Lung function tests. * Liver function tests. * Evaluate for brain effects such as changes in memory, concentration, sleeping patterns and mood (especially irritability and social withdrawal), as well as headaches and fatigue. Consider evaluations of the cerebellar, autonomic and peripheral nervous systems. Positive and borderline individuals should be referred for neuropsychological testing. Any evaluation should include a careful history of past and present symptoms with an exam. Medical tests that look for damage already done are not a substitute for controlling exposure. Request copies of your medical testing. You have a legal right to this information under OSHA 1910.1020. Mixed Exposures * Because smoking can cause heart disease, as well as lung cancer, emphysema, and other espiratory problems, it may worsen respiratory conditions caused by chemical exposure. Even if you have smoked for a long time, stopping now will reduce your risk of developing health problems. * Because more than light alcohol consumption can cause liver damage, drinking alcohol may increase the liver damage caused by Isopropyl Acetate. WORKPLACE CONTROLS AND PRACTICES Unless a less toxic chemical can be substituted for a hazardous substance, ENGINEERING CONTROLS are the most effective way of reducing exposure. The best protection is to enclose operations and/or provide local exhaust ventilation at the site of chemical release. Isolating operations can also reduce exposure. Using respirators or protective equipment is less effective than the controls mentioned above, but is sometimes necessary. In evaluating the controls present in your workplace, consider: (1) how hazardous the substance is, (2) how much of the substance is released into the workplace and (3) whether harmful skin or eye contact could occur. Special controls should be in place for highly toxic chemicals or when significant skin, eye, or breathing exposures are possible. In addition, the following controls are recommended: * Where possible, automatically pump liquid Isopropyl Acetate from drums or other storage containers to process containers. * Before entering a confined space where Isopropyl Acetate may be present, check to make sure that an explosive concentration does not exist. Good WORK PRACTICES can help to reduce hazardous exposures. The following work practices are recommended: * Workers whose clothing has been contaminated by Isopropyl Acetate should change into clean clothing promptly. * Contaminated work clothes should be laundered by individuals who have been informed of the hazards of exposure to Isopropyl Acetate. * Eye wash fountains should be provided in the immediate work area for emergency use. * If there is the possibility of skin exposure, emergency shower facilities should be provided. * On skin contact with Isopropyl Acetate, immediately wash or shower to remove the chemical. At the end of the workshift, wash any areas of the body that may have contacted Isopropyl Acetate, whether or not known skin contact has occurred. * Do not eat, smoke, or drink where Isopropyl Acetate is handled, processed, or stored, since the chemical can be swallowed. Wash hands carefully before eating, drinking, smoking, or using the toilet. PERSONAL PROTECTIVE EQUIPMENT WORKPLACE CONTROLS ARE BETTER THAN PERSONAL PROTECTIVE EQUIPMENT. However, for some jobs (such as outside work, confined space entry, jobs done only once in a while, or jobs done while workplace controls are being installed), personal protective equipment may be appropriate. OSHA 1910.132 requires employers to determine the appropriate personal protective equipment for each hazard and to train employees on how and when to use protective equipment. The following recommendations are only guidelines and may not apply to every situation. Clothing * Avoid skin contact with Isopropyl Acetate. Wear solventresistant gloves and clothing. Safety equipment suppliers/ manufacturers can provide recommendations on the most protective glove/clothing material for your operation. * All protective clothing (suits, gloves, footwear, headgear) should be clean, available each day, and put on before work. Eye Protection * Wear indirect-vent, impact and splash resistant goggles when working with liquids. * Wear a face shield along with goggles when working with corrosive, highly irritating or toxic substances. * Contact lenses should not be worn when working with this substance. Respiratory Protection IMPROPER USE OF RESPIRATORS IS DANGEROUS. Such equipment should only be used if the employer has a written program that takes into account workplace conditions, requirements for worker training, respirator fit testing and medical exams, as described in OSHA 1910.134. * Where the potential exists for exposure over 100 ppm, use a NIOSH approved supplied-air respirator with a full facepiece operated in a pressure-demand or other positivepressure mode. For increased protection use in combination with an auxiliary self-contained breathing apparatus operated in a pressure-demand or other positive-pressure mode. * Exposure to 1,800 ppm is immediately dangerous to life and health. If the possibility of exposure above 1,800 ppm exists, use a NIOSH approved self-contained breathing apparatus with a full facepiece operated in a pressuredemand or other positive-pressure mode equipped with an emergency escape air cylinder. HANDLING AND STORAGE * Prior to working with Isopropyl Acetate you should be trained on its proper handling and storage. * Isopropyl Acetate is not compatible with OXIDIZING AGENTS (such as PERCHLORATES, PEROXIDES, PERMANGANATES, CHLORATES, NITRATES, CHLORINE, BROMINE and FLUORINE); STRONG ACIDS (such as HYDROCHLORIC, SULFURIC and NITRIC); STRONG BASES (such as SODIUM HYDROXIDE and POTASSIUM HYDROXIDE); and COMBUSTIBLE MATERIALS. * Store in tightly closed containers in a cool, well-ventilated area away from MOISTURE and HEAT. * Sources of ignition, such as smoking and open flames, are prohibited where Isopropyl Acetate is used, handled, or stored. * Metal containers involving the transfer of Isopropyl Acetate should be grounded and bonded. * Use only non-sparking tools and equipment, especially when opening and closing containers of Isopropyl Acetate. Q: When are higher exposures more likely? A: Conditions which increase risk of exposure include physical and mechanical processes (heating, pouring, spraying, spills and evaporation from large surface areas such as open containers), and "confined space" exposures (working inside vats, reactors, boilers, small rooms, etc.). Q: Is the risk of getting sick higher for workers than for community residents? A: Yes. Exposures in the community, except possibly in cases of fires or spills, are usually much lower than those found in the workplace. However, people in the community may be exposed to Contaminated water as well as to chemicals in the air over long periods. This may be a problem for Industrial Hygiene Information Industrial hygienists are available to answer your questions regarding the control of chemical exposures using exhaust ventilation, special work practices, good housekeeping, good hygiene practices, and personal protective equipment including respirators. In addition, they can help to interpret the results of industrial hygiene survey data. Medical Evaluation If you think you are becoming sick because of exposure to chemicals at your workplace, you may call personnel at the Department of Health and Senior Services, Occupational Health Service, who can help you find the information you need. Public Presentations Presentations and educational programs on occupational health or the Right to Know Act can be organized for labor unions, trade associations and other groups. A carcinogen is a substance that causes cancer. The CAS number is assigned by the Chemical Abstracts Service to identify a specific chemical. CFR is the Code of Federal Regulations, which consists of the regulations of the United States government. A combustible substance is a solid, liquid or gas that will burn. A corrosive substance is a gas, liquid or solid that causes irreversible damage to human tissue or containers. A fetus is an unborn human or animal. A flammable substance is a solid, liquid, vapor or gas that will ignite easily and burn rapidly. The flash point is the temperature at which a liquid or solid gives off vapor that can form a flammable mixture with air. IARC is the International Agency for Research on Cancer, a scientific group that classifies chemicals according to their cancer-causing potential. IRIS is the Integrated Risk Information System database of the federal EPA. A miscible substance is a liquid or gas that will evenly dissolve in another. It is a measure of concentration (weight/volume). A mutagen is a substance that causes mutations. A mutation is a change in the genetic material in a body cell. Mutations can lead to birth defects, miscarriages, or cancer. NAERG is the North American Emergency Response Guidebook. It was jointly developed by Transport Canada, the United States Department of Transportation and the Secretariat of Communications and Transportation of Mexico. It is a guide for first responders to quickly identify the specific or generic hazards of material involved in a transportation incident, and to protect themselves and the general public during the initial response phase of the incident. NFPA is the National Fire Protection Association. It classifies substances according to their fire and explosion hazard. NIOSH is the National Institute for Occupational Safety and Health. It tests equipment, evaluates and approves respirators, conducts studies of workplace hazards, and proposes standards to OSHA. NTP is the National Toxicology Program which tests chemicals and reviews evidence for cancer. OSHA is the Occupational Safety and Health Administration, which adopts and enforces health and safety standards. PEL is the Permissible Exposure Limit which is enforceable by the Occupational Safety and Health Administration. PIH is a DOT designation for chemicals which are Poison Inhalation Hazards. >>>>>>>>>>>>>>>>> E M E R G E N C Y I N F O R M A T I O N <<<<<<<<<<<<<<<<< Common Name: ISOPROPYL ACETATE DOT Number: UN 1220 FIRE HAZARDS * Isopropyl Acetate is a FLAMMABLE LIQUID. * Use dry chemical, CO2, alcohol or polymer foam extinguishers, as water may not be effective in fighting fires. * POISONOUS GASES ARE PRODUCED IN FIRE. * CONTAINERS MAY EXPLODE IN FIRE. * Use water spray to keep fire-exposed containers cool. * Vapors may travel to a source of ignition and flash back. * Vapor is heavier than air and may travel a distance to cause a fire or explosion far from the source. * If employees are expected to fight fires, they must be trained and equipped as stated in OSHA 1910.156. SPILLS AND EMERGENCIES If Isopropyl Acetate is spilled or leaked, take the following steps: * Evacuate persons not wearing protective equipment from area of spill or leak until clean-up is complete. * Remove all ignition sources. * Cover with an activated charcoal adsorbent and place in covered containers for disposal. * Ventilate and wash area after clean-up is complete. * Keep Isopropyl Acetate out of a confined space, such as a sewer, because of the possibility of an explosion, unless the sewer is designed to prevent the build-up of explosive concentrations. * It may be necessary to contain and dispose of Isopropyl Acetate as a HAZARDOUS WASTE. Contact your state Department of Environmental Protection (DEP) or your regional office of the federal Environmental Protection Agency (EPA) for specific recommendations. * If employees are required to clean-up spills, they must be properly trained and equipped. OSHA 1910.120(q) may be applicable. FOR LARGE SPILLS AND FIRES immediately call your fire department. You can request emergency information from the following: FIRST AID For POISON INFORMATION Eye Contact * Immediately flush with large amounts of water for at least 15 minutes, occasionally lifting upper and lower lids. Seek medical attention immediately. Skin Contact * Remove contaminated clothing. Wash contaminated skin with soap and water. Breathing * Remove the person from exposure. * Begin rescue breathing (using universal precautions) if breathing has stopped and CPR if heart action has stopped. * Transfer promptly to a medical facility. PHYSICAL DATA Vapor Pressure: 42 mm Hg at 68oF (20oC) Flash Point: 36oF (2oC) Water Solubility: Slightly soluble

Isopropyl Alcohol Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is an organic compound, an isomer of n-propanol, aliased dimethylmethanol, 2-propanol. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is a colorless, transparent liquid with a scent like a mixture of ethanol and acetone. Soluble in water, also soluble in most organic solvents such as alcohol, ether, benzene, chloroform, etc. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) has a wide range of uses as an organic raw material and solvent. 1）As a chemical raw material, it can produce acetone, hydrogen peroxide, methyl isobutyl ketone, diisobutyl ketone, isopropylamine, diisopropyl ether, isopropyl chloride, and fatty acid isopropyl ester and chloro fatty acid isopropyl ester. 2）In the fine chemical industry, it can be used to produce isopropyl nitrate, isopropyl xanthate, triisopropyl phosphite, aluminum isopropoxide, pharmaceuticals and pesticides, etc. It can also be used to produce diisopropanone, isopropyl acetate and Thymol and gasoline additives. 3）Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) Can be used to produce coatings, inks, extractants, aerosols, etc. 4) In the electronics industry, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) can be used as a cleaning and degreasing agent. 5) In the oil and fat industry, the extractant of cottonseed oil can also be used for degreasing of animal-derived tissue membranes. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) (IUPAC name propan-2-ol; commonly called isopropanol or 2-propanol) is a colorless, flammable chemical compound (chemical formula CH3CHOHCH3) with a strong odor.[8] As an isopropyl group linked to a hydroxyl group, it is the simplest example of a secondary alcohol, where the alcohol carbon atom is attached to two other carbon atoms. It is a structural isomer of 1-propanol and ethyl methyl ether. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is used in the manufacture of a wide variety of industrial and household chemicals and is a common ingredient in chemicals such as antiseptics, disinfectants, and detergents. Names of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is also known as 2-propanol, sec-propyl alcohol, IPA, or isopropanol. IUPAC considers isopropanol an incorrect name as the hydrocarbon isopropane does not exist. Properties of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is miscible in water, ethanol, ether, and chloroform. It dissolves ethyl cellulose, polyvinyl butyral, many oils, alkaloids, gums and natural resins.[9] Unlike ethanol or methanol, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is not miscible with salt solutions and can be separated from aqueous solutions by adding a salt such as sodium chloride. The process is colloquially called salting out, and causes concentrated Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) to separate into a distinct layer. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) forms an azeotrope with water, which gives a boiling point of 80.37 °C (176.67 °F) and a composition of 87.7 wt% (91 vol%) Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA). Water–Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) mixtures have depressed melting points.[10] It has a slightly bitter taste, and is not safe to drink. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) becomes increasingly viscous with decreasing temperature and freezes at −89 °C (−128 °F). Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) has a maximal absorbance at 205 nm in an ultraviolet–visible spectrum. Reactions of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) can be oxidized to acetone, which is the corresponding ketone. This can be achieved using oxidizing agents such as chromic acid, or by dehydrogenation of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) over a heated copper catalyst: (CH3)2CHOH → (CH3)2CO + H2 Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is often used as both solvent and hydride source in the Meerwein-Ponndorf-Verley reduction and other transfer hydrogenation reactions. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) may be converted to 2-bromopropane using phosphorus tribromide, or dehydrated to propene by heating with sulfuric acid. Like most alcohols, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) reacts with active metals such as potassium to form alkoxides that can be called isopropoxides. The reaction with aluminium (initiated by a trace of mercury) is used to prepare the catalyst aluminium isopropoxide.[14] History of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) In 1920, Standard Oil first produced Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) by hydrating propene. Its major use at the time was not rubbing alcohol but for oxidation to acetone, whose first major use was in World War I for the preparation of cordite, a smokeless, low explosive propellant. Production of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) In 1994, 1.5 million tonnes of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) were produced in the United States, Europe, and Japan.[16] It is primarily produced by combining water and propene in a hydration reaction or by hydrogenating acetone. There are two routes for the hydration process and both processes require that the Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) be separated from water and other by-products by distillation. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) and water form an azeotrope, and simple distillation gives a material that is 87.9% by weight Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) and 12.1% by weight water.[18] Pure (anhydrous) Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is made by azeotropic distillation of the wet Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) using either diisopropyl ether or cyclohexane as azeotroping agents.[16] Biological of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) Small amounts of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) are produced in the body in diabetic ketoacidosis.[19] Indirect hydration of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) Indirect hydration reacts propene with sulfuric acid to form a mixture of sulfate esters. This process can use low-quality propene, and is predominant in the USA. These processes give primarily Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) rather than 1-propanol, because adding water or sulfuric acid to propene follows Markovnikov's rule. Subsequent hydrolysis of these esters by steam produces Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA), by distillation. Diisopropyl ether is a significant by-product of this process; it is recycled back to the process and hydrolyzed to give the desired product. CH3CH=CH2 + H2O H2SO4⟶ (CH3)2CHOH Direct hydration of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) See also: Heteropoly acid Direct hydration reacts propene and water, either in gas or liquid phase, at high pressures in the presence of solid or supported acidic catalysts. This type of process usually requires higher-purity propylene (> 90%).[16] Direct hydration is more commonly used in Europe. Hydrogenation of acetone Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) may be prepared via the hydrogenation of acetone, however this approach involves an extra step compared to the above methods, as acetone is itself normally prepared from propene via the cumene process.[16] It may remain economical depending on the value of the products. A known issue is the formation of MIBK and other self-condensation products. Raney nickel was one of the original industrial catalysts, modern catalysts are often supported bimetallic materials. This is an efficient process and easy Uses of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) One of the small scale uses of isopropanol is in cloud chambers. Isopropanol has ideal physical and chemical properties to form a supersaturated layer of vapor which can be condensed by particles of radiation. In 1990, 45,000 metric tonnes of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) were used in the United States, mostly as a solvent for coatings or for industrial processes. In that year, 5400 metric tonnes were used for household purposes and in personal care products. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is popular in particular for pharmaceutical applications,[16] due to its low toxicity. Some Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is used as a chemical intermediate. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) may be converted to acetone, but the cumene process is more significant. [16] Solvent of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) dissolves a wide range of non-polar compounds. It also evaporates quickly, leaves nearly zero oil traces, compared to ethanol, and is relatively non-toxic, compared to alternative solvents. Thus, it is used widely as a solvent and as a cleaning fluid, especially for dissolving oils. Together with ethanol, n-butanol, and methanol, it belongs to the group of alcohol solvents, about 6.4 million tonnes of which were used worldwide in 2011.[20] Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is commonly used for cleaning eyeglasses, electrical contacts, audio or video tape heads, DVD and other optical disc lenses, removing thermal paste from heatsinks on CPUs and other IC packages, etc. Intermediate Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is esterified to give isopropyl acetate, another solvent. It reacts with carbon disulfide and sodium hydroxide to give sodium isopropylxanthate, a herbicide and an ore flotation reagent.[21] Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) reacts with titanium tetrachloride and aluminium metal to give titanium and aluminium isopropoxides, respectively, the former a catalyst, and the latter a chemical reagent.[16] This compound may serve as a chemical reagent in itself, by acting as a dihydrogen donor in transfer hydrogenation. Medical of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) Rubbing alcohol, hand sanitizer, and disinfecting pads typically contain a 60–70% solution of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) or ethanol in water. Water is required to open up membrane pores of bacteria, which acts as a gateway for Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA). A 75% v/v solution in water may be used as a hand sanitizer.[22] Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is used as a water-drying aid for the prevention of otitis externa, better known as swimmer's ear.[23] Early uses as an anesthetic Although Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) can be used for anesthesia, its many negative attributes or drawbacks prohibit this use. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) can also be used similarly to ether as a solvent[24] or as an anesthetic by inhaling the fumes or orally. Early uses included using the solvent as general anesthetic for small mammals[25] and rodents by scientists and some veterinarians. However, it was soon discontinued, as many complications arose, including respiratory irritation, internal bleeding, and visual and hearing problems. In rare cases, respiratory failure leading to death in animals was observed. Automotive Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is a major ingredient in "gas dryer" fuel additives. In significant quantities, water is a problem in fuel tanks, as it separates from gasoline and can freeze in the supply lines at low temperatures. Alcohol does not remove water from gasoline, but the alcohol solubilizes water in gasoline. Once soluble, water does not pose the same risk as insoluble water, as it no longer accumulates in the supply lines and freezes but is consumed with the fuel itself. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is often sold in aerosol cans as a windshield or door lock deicer. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is also used to remove brake fluid traces from hydraulic braking systems, so that the brake fluid (usually DOT 3, DOT 4, or mineral oil) does not contaminate the brake pads and cause poor braking. Mixtures of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) and water are also commonly used in homemade windshield washer fluid. Laboratory As a biological specimen preservative, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) provides a comparatively non-toxic alternative to formaldehyde and other synthetic preservatives. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) solutions of 70–99% are used to preserve specimens. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is often used in DNA extraction. A lab worker adds it to a DNA solution to precipitate the DNA, which then forms a pellet after centrifugation. This is possible because DNA is insoluble in Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA). Safety of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) vapor is denser than air and is flammable, with a flammability range of between 2 and 12.7% in air. It should be kept away from heat and open flame.[26] Distillation of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) over magnesium has been reported to form peroxides, which may explode upon concentration. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is a skin irritant. Wearing protective gloves is recommended. Toxicology of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) and its metabolite, acetone, act as central nervous system (CNS) depressants.[31] Poisoning can occur from ingestion, inhalation, or skin absorption. Symptoms of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) poisoning include flushing, headache, dizziness, CNS depression, nausea, vomiting, anesthesia, hypothermia, low blood pressure, shock, respiratory depression, and coma.[31] Overdoses may cause a fruity odor on the breath as a result of its metabolism to acetone.[32] Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) does not cause an anion gap acidosis but it produces an osmolal gap between the calculated and measured osmolalities of serum, as do the other alcohols.[31] Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is oxidized to form acetone by alcohol dehydrogenase in the liver,[31] and has a biological half-life in humans between 2.5 and 8.0 hours.[31] Unlike methanol or ethylene glycol poisoning, the metabolites of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) are considerably less toxic, and treatment is largely supportive. Furthermore, there is no indication for the use of fomepizole, an alcohol dehydrogenase inhibitor, unless co-ingestion with methanol or ethylene glycol is suspected. In forensic pathology, people who have died as a result of diabetic ketoacidosis usually have blood concentrations of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) of tens of mg/dL, while those by fatal Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) ingestion usually have blood concentrations of hundreds of mg/dL. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) will attack some forms of plastics, rubber, and coatings. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is an isomer of propyl alcohol with antibacterial properties. Although the exact mechanism of isopropanol's disinfecting action is not known, it might kill cells by denaturing cell proteins and DNA, interfering with cellular metabolism, and dissolving cell lipo-protein membranes. Isopropanol is used in soaps and lotions as an antiseptic. Any clothing which becomes wet with liquid Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) should be removed immediately and not reworn until the Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is removed from the clothing. Clothing should then be placed in closed containers for storage until it can be discarded or until provision can be made for the removal of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) from the clothing. If the clothing is to be laundered or otherwise cleaned to remove the Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA), the person performing the operation should be informed of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)'s hazardous properties. When a stream of hydrogen entrained Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) vapors and palladium particles, the mixture caught fire on exposure to air. Solutions of 90% nitroform in 10% Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) in polyethylene bottles exploded. The reaction between Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) and phosgene forms isopropyl chloroformate and hydrogen chloride. In the presence of iron salts thermal decomposition can occur, which in some cases can become explosive. Mixing oleum and Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) in a closed container caused the temperature and pressure to increase. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) (without residue) may be used in inks for marking food supplements in tablet form, gum, and confectionery. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) may be present in the following foods under the conditions specified: (a) In spice oleoresins as a residue from the extraction of spice, at a level not to exceed 50 parts per million. (b) In lemon oil as a residue in production of the oil, at a level not to exceed 6 parts per million. (c) In hops extract as a residue from the extraction of hops at a level not to exceed 2.0 percent by weight: Provided, that, (1) The hops extract is added to the wort before or during cooking in the manufacture of beer. (2) The label of the hops extract specifies the presence of the Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) and provides for the use of the hops extract only as prescribed by paragraph (c)(1) of this section. WORKERS IN AN Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) PACKAGING PLANT BECAME ILL AFTER ACCIDENTAL EXPOSURE TO CARBON TETRACHLORIDE. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) POTENTIATION OF CARBON TETRACHLORIDE TOXICITY HAS BEEN SHOWN PREVIOUSLY ONLY IN RATS. ACETONE, A PRODUCT OF Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) METABOLISM, IS A MAJOR POTENTIATOR OF CARBON TETRACHLORIDE TOXICITY. IDENTIFICATION: Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is an aliphatic alcohol hydrocarbon. It is prepared from propylene, which is obtained in the cracking of petroleum or by the reduction of acetone. It is a colorless liquid which is soluble in water, alcohol, ether, acetone, benzene and chloroform. It is insoluble in salt solutions. It has a slight odor resembling a mixture of ethanol and acetone and has a slight bitter taste. It is used in antifreeze, industrial solvent, solvent for gums, shellac, essential oils, in quick drying oils, creosote and resins; extraction of alkaloids; in quick drying inks; in denaturing ethyl alcohol; in body rubs, hand lotions, after shave lotions, cosmetics and pharmaceuticals; in manufacture of acetone, glycerol, isopropyl acetate; antiseptic; rubefacient ; and pharmaceutical aid. HUMAN EXPOSURE: Toxic effects include central nervous depression, liver, kidney, cardiovascular depression and brain damage. It can cause drowsiness, ataxia, stupor, coma and respiratory depression, irritation of mucous membranes and eyes, gastritis, gastric hemorrhage, vomiting, pancreatitis, cold clammy skin, hypothermia, miosis, tachycardia, slow and noisy respiration. High risk of circumstances of poisoning: Accidental ingestion of rubbing alcohols/toiletries by children. There is a potential exposure from dermal and inhalation exposure in children during Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) sponging for control of fever. Intentional ingestion for alcoholic effect or in suicide attempts. Occupational or accidental exposure to liquid or its vapor in industrial applications. Individuals exposed to Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) include the following: workers in the pharmaceutical industry, cosmetic industry, chemical industry, petroleum workers, laboratory workers, printers, painters and carpenters and cabinet makers. There is little absorption through intact skin. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is a potent eye and skin irritant. 80% of an oral dose is absorbed within 30 minutes. Absorption is complete within 2 hours although this may be delayed in a large overdose. Alveolar concentration is correlated to the environmental concentration at any given time. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is absorbed through intact skin on prolonged exposure. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) distributes in body water with an apparent volume of distribution of 0.6-0.7 L/kg. 20-50% of an absorbed dose is excreted unchanged. Most Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is oxidized in the liver by alcohol dehydrogenase to acetone, formate and finally carbon dioxide. Acetone is slowly eliminated by the lung (40%) or kidney. Clinically insignificant excretion occurs into the stomach and saliva. Related keto acids are not produced in sufficient quantities to cause a severe metabolic acidosis. Inebriation, peripheral vasodilation has occurred. In children, hypoglycemia is particularly severe when poisoning following fasting, exercise or chronic malnutrition Lactic acidosis may occur in patients with severe liver disease, pancreatitis or receiving biguanide therapy or as a result of the hypovolemia which frequently accompanies severe intoxication. ANIMAL STUDIES: Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) most closely follows first order kinetics, with a half life of 2.5 to 3.2 hours. The elimination half life of the active metabolite acetone is significantly prolonged to about 5 hours in rats. In rat hepatocytes the following has been observed: marked depletion of glutathione, increased malondialdehyde production, decreased protein sulfhydryls content and leakage of lactic dehydrogenase with loss of membrane activity. A complete history and physical examination should be performed to detect pre existing conditions that might place the employee at increased risk, and to establish a baseline for future health monitoring. Examination of the skin, liver, kidneys, and respiratory system should be stressed. Skin disease: Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is a defatting agent and can cause dermatitis on prolonged exposure. Persons with pre existing skin disorders may be more susceptible to the effects of this agent. Liver disease: Although Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is not known as a liver toxin in humans, the importance of this organ in the biotransformation and detoxification of foreign substances should be considered before exposing persons with impaired liver function. Kidney disease: Although Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is not known as a kidney toxin in humans, the importance of this organ in the elimination of toxic substances justifies special consideration in those with impaired renal function. Chronic respiratory disease: In persons with impaired pulmonary function, especially those with obstructive airway diseases, the breathing of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) might cause exacerbation of symptoms due to its irritant properties. Periodic Medical Examination: The aforementioned medical examinations should be repeated on an annual basis. The assessment of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) exposure can be accomplished through measurement of either Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) or acetone. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) measurement has not been found to be a good assessment of low level exposure, due to its low sensitivity. However, measurement of acetone has been found to be a good indicator of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) exposure for exposures as low as 70 ppm, and has been found to correlate well with air concentrations. Whole Blood Reference Ranges: Normal - none detected (Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)); Exposed - BAT (sampling time is end of exposure or end of shift, measured as the metabolite, acetone), 50 mg/l; Toxic - Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) level associated with serious toxic symptoms is 150 mg/l. Serum or Plasma Reference Ranges: Normal - none detected (Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)); Exposed - not established; and Toxic - not established. Urine Reference Ranges: The assessment of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) exposure can be accomplished through measurement of either Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) or acetone. However only acetone was found to be a useful test, due to its greater sensitivity and good correlation with air exposure levels. Normal - none detected (Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)); Exposed - BAT (sampling time is end of exposure or end of shift, measured as the metabolite, acetone), 50 mg/l; Toxic - Not established. Persons with pre existing skin disorders may be more susceptible to the effects of this agent. ... In persons with impaired pulmonary function, especially those with obstructive airway diseases, the breathing of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) might cause exacerbation of symptoms due to its irritant properties. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)'s production and use in the manufacture of acetone, glycerol, and isopropyl acetate and as a solvent for a variety of applications may result in its release to the environment through various waste streams. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)'s use in hydraulic fracturing fluids results in its direct release to the environment. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) has been identified as a metabolic product of aerobic microorganisms, anaerobic microorganisms, fungi, and yeast. If released to air, a vapor pressure of 45.4 mm Hg at 25 °C indicates Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) will exist solely as a vapor in the ambient atmosphere. Vapor-phase Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) will be degraded in the atmosphere by reaction with photochemically-produced hydroxyl radicals; the half-life for this reaction in air is estimated to be 3.2 days. If released to soil, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is expected to have very high mobility based upon an estimated Koc of 1.5. Volatilization from moist soil surfaces is expected to be an important fate process based upon a Henry's Law constant of 8.10X10-6 atm-cu m/mole. Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is expected to volatilize from dry soil surfaces based upon its vapor pressure. If released into water, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is not expected to adsorb to suspended solids and sediment based upon the estimated Koc. Volatilization from water surfaces is expected to be an important fate process based upon this compound's Henry's Law constant. Estimated volatilization half-lives for a model river and model lake are 86 hours and 29 days, respectively. An estimated BCF of 3 suggests the potential for bioconcentration in aquatic organisms is low. Hydrolysis is not expected to occur due to the lack of hydrolyzable functional groups. Biodegradation is expected to be an important fate process based on the results of microbial screening tests. Occupational exposure to Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) may occur through inhalation and dermal contact with this compound at workplaces where Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is produced or used. Monitoring data indicate that the general population may be exposed to Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) via inhalation of ambient air, ingestion of food and drinking water, and dermal contact with this compound directly and from consumer products containing Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA). ANAEROBIC: Typical Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) removal efficiencies for an anaerobic lagoon treatment facility, with a retention time of 15 days, were 50% after loading with dilute waste, and 69 and 74% after loading with concentrated wastes(1). In closed bottle studies, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) was completely degraded anaerobically by an acetate-enriched culture, derived from a seed of domestic sludge(1). The culture started to use cross-fed Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA), after 4 days, at a rate of 200 mg/L/day(1). In a mixed reactor with a 20-day retention time, seeded by the same culture, 56% removal was achieved in the 20 days following 70 days of acclimation to a final concentration of 10,000 mg/L(1). The avg percent removal of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) in semi-pilot scale anaerobic lagoons was 50% in 7.5-10 days for dilute wastes with 60 ppm Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) and 69-74% in 20-40 days for concentrated wastes with 175 ppm Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)(2). Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) was readily mineralized to methane and carbon dioxide under methanogenic conditions(3). The degradation rate of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) under these conditions in fuel impacted river sediments and industrial/sewage impacted creek sediments was 2.4 ppm C/day (82% of expected methane recovery) and 3.0 ppm C/day (91% of expected methane recovery), respectively(3). The degradation rate of Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) in a sediment slurry from a shallow anoxic aquifer under methanogenic conditions was 7.6 ppm C/day (112% of theoretical methane recovery)(4). In anaerobic bioreactor studies using a granular sludge inocula, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) (at 125 ppm initial concentration) degraded with 115.5% of theoretical methane production over a 21-day incubation period(5); acetone was identified as a metabolite(5). In laboratory anaerobic sludge reactor tests using liquid hen manure as inoculum, Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) was degraded 100% in a 13-day incubation period with lag period(6). The Henry's Law constant for Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is 8.10X10-6 atm-cu m/mole at 25 °C(1). This Henry's Law constant indicates that Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA) is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 86 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 29 days(SRC). Isopropyl alcohol (izopropil alkol, isopropyl alcohol, IPA)'s Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Isopropyl alcohol (izopropil

ISOPROPYL ISOSTEARATE, N° CAS : 31478-84-9 / 68171-33-5. Nom INCI : ISOPROPYL ISOSTEARATE. Nom chimique : Isopropyl isodecanoate. N° EINECS/ELINCS : 250-651-1 / 269-023-3. Agent fixant : Permet la cohésion de différents ingrédients cosmétiques. Emollient : Adoucit et assouplit la peau. Agent d'entretien de la peau : Maintient la peau en bon état

Isopropyl bromide is also known as 75-26-3, 2-bromo-propane, 2-Bromopropane, Propan-2-bromo with Molecular Formula of C3H7Br and Molecular Weight of 122.99168.
Isopropyl bromide is manufactured by heating isopropyl alcohol with HBr and is available in colorless liquid form.
Isopropyl bromide is also used as an intermediate to form alkylated amines and alkylated metallic compounds.

CAS Number: 75-26-3
EC Number: 200-855-1
Molecular Formula: 13C3H7Br
Molecular Weight: 125.97

Isopropyl bromide, also known as 2-Bromopropane and 2-propyl bromide, is the halogenated hydrocarbon with the formula CH3CHBrCH3.
Isopropyl bromide is a colorless liquid.

Isopropyl bromide is used for introducing the isopropyl functional group in organic synthesis.
Isopropyl bromide is prepared by heating isopropanol with hydrobromic acid.

Isopropyl bromide serves as an alkylating agent in organic synthesis.
Isopropyl bromide is also used as an intermediate to form alkylated amines and alkylated metallic compounds.

Further, Isopropyl bromide acts as a solvent for industrial cleaning, degreasing, metal processing and finishing, electronics, aerospace and aviation, aerosols, textiles, adhesives and inks.
In addition, Isopropyl bromide is used for introducing the isopropyl functional group in organic synthesis.

Isopropyl Bromide is also known as 75-26-3, 2-bromo-propane, 2-Bromopropane, Propan-2-bromo with Molecular Formula of C3H7Br and Molecular Weight of 122.99168.
Isopropyl bromide is manufactured by heating isopropyl alcohol with HBr and is available in colorless liquid form.

Isopropyl bromide is an organobromide compound.
Isopropyl bromide is used for introducing the isopropyl functional group in organic synthesis.

Isopropyl bromide is sometimes used as an alternative to ozone-depleting cleaning solvents such as chlorofluorocarbons.
Isopropyl bromide is prepared by heating isopropanol with hydrobromic acid.

Isopropyl Bromide is also known as 75-26-3, 2-bromo-propane, 2-Bromopropane, Propan-2-bromo with Molecular Formula of C3H7Br and Molecular Weight of 122.99168.
Isopropyl bromide is manufactured by heating isopropyl alcohol with HBr and is available in colorless liquid form.

Some of Isopropyl bromide properties include Boiling Point of 59-60°C, Melting Point of -89.0°C, Density/Specific Gravity of 1.31 at 20°C/4°C with miscible solubility with chloroform, ether, alcohol, benzene; slight solubility in acetone and in water (3,180 mg/L at 20°C).
Further, Isopropyl bromide has Surface Tension of 3.5348X10-2 N/m at melting point, Vapor Density of 4.27 (Air=1) and Vapor Pressure of 216 mm Hg at 25°C.

Isopropyl bromide, also known as 2-Bromopropane or 2-propyl bromide, is used for introducing the isopropyl functional group in organic synthesis.
Ungraded products supplied by Spectrum are indicative of a grade suitable for general industrial use or research purposes and typically are not suitable for human consumption or therapeutic use.

Isopropyl bromide has proved to be a useful reagent for amino acids dissolved in dimethylsulfoxide/sodium hydride, except for the determination of arginine.
Methylation of acids with diazomethane has also been used for metabolic profiling despite the formation of artefacts.

Resin-mediated methylation of polyfunctional acids found in fruit juices has also proved successful.
Fumaric, succinic, malic, tartaric, isocitric and citric acids, isolated from fruit juices by trapping onto anionic ion exchange resins, can be efficiently converted to methyl esters by reaction with methyl iodide in both supercritical carbon dioxide and acetonitrile.

To provide for the analysis of even short chain fatty acids in serum, a procedure has been developed with benzyl bromide.
This has been successfully employed for serum and urine organic acid profiling.
The method cannot be used for citric acid or sugar-related acids.

Exposure to Isopropyl bromide has been associated with adverse reproductive effects in men and women.
There are also some reports suggesting that maternal formaldehyde exposure is related to delayed conception and miscarriage, and exposure to trinitrotoluene or trichloroethylene may be harmful for the reproductive health of men.
Formamide, dimethylformamide and n-methyl-2-pyrrolidone have also been shown to cause fetotoxic and teratogenic effects in laboratory animals, but there are no data on their effects in humans.

In summary, the epidemiologic evidence suggests that high maternal exposure to solvents may represent a hazard for the developing fetus and may impair female fertility.
The results for male fertility are less conclusive.

The findings on individual solvents must also be interpreted with caution, because coincident exposure to several agents makes Isopropyl Bromide difficult to ascribe adverse effects to a specific compound.
Nevertheless, the study results are supportive of adverse effects of some glycol ethers, tetrachloroethylene, toluene, benzene and carbon disulfide on reproduction.
Isopropyl Bromide would be prudent to minimize exposure to organic solvents.

Some of Isopropyl Bromide properties include Boiling Point of 59-60°C, Melting Point of -89.0°C, Density/Specific Gravity of 1.31 at 20°C/4°C with miscible solubility with chloroform, ether, alcohol, benzene; slight solubility in acetone and in water (3,180 mg/L at 20°C).
Further, Isopropyl Bromide has Surface Tension of 3.5348X10-2 N/m at melting point, Vapor Density of 4.27 (Air=1) and Vapor Pressure of 216 mm Hg at 25°C.

Isopropyl bromide, also known as 2-Bromopropane and 2-propyl bromide, is the halogenated hydrocarbon with the formula CH3CHBrCH3.
Isopropyl Bromide is a colorless liquid.

Isopropyl Bromide is used for introducing the isopropyl functional group in organic synthesis.
Isopropyl bromide is prepared by heating isopropanol with hydrobromic acid.

Applications of Isopropyl bromide:
Isopropyl bromide is used for introducing the isopropyl functional group in organic synthesis.
Isopropyl bromide is also used as an intermediate to form alkylated amines and alkylated metallic compounds.

Further, Isopropyl bromide acts as a solvent for industrial cleaning, degreasing, metal processing and finishing, electronics, aerospace and aviation, aerosols, textiles, adhesives and inks.
In addition, Isopropyl bromide is used for introducing the isopropyl functional group in organic synthesis.

Isopropyl bromide is the insecticide fenvalerate, fenvalerate, propoxur, bactericide, rustamine, fluoroamide and herbicide, an intermediate of the phosphorus of sarcandra.
Isopropyl bromide is used in organic synthesis and pharmaceutical industry

Isopropyl bromide is used in organic synthesis and pharmaceutical, pesticide intermediates
Isopropyl bromide is used as Grignard reagents and raw materials, intermediates of drugs and dyes are also used in the manufacture of pesticides (bisulfate) and the like.

Uses of Isopropyl bromide:
Isopropyl bromide serves as an alkylating agent in organic synthesis.
Isopropyl bromide is also used as an intermediate to form alkylated amines and alkylated metallic compounds.

Further, Isopropyl bromide acts as a solvent for industrial cleaning, degreasing, metal processing and finishing, electronics, aerospace and aviation, aerosols, textiles, adhesives and inks.
In addition, Isopropyl bromide is used for introducing the isopropyl functional group in organic synthesis.

Isopropyl bromide is used as a freon substitute.
Isopropyl bromide is used in organic synthesis.

Isopropyl bromide is used in the synthesis of pharmaceuticals, dyes and other organics.
Isopropyl bromide is an industrial and laboratory chemical.

Industry Uses:
Intermediates

Industrial Processes with risk of exposure:
Metal Degreasing

Nature of Isopropyl bromide:
Isopropyl bromide is colorless volatile liquid.
Isopropyl bromide is relative density is 1. 3140(20 ℃).

Isopropyl bromide is melting Point -89 °c.
Isopropyl bromide is boiling Point 59. 38 °c.

Isopropyl bromide is refractive index 1.4251(20 degrees C).
Isopropyl bromide is slightly soluble in water, with alcohol, ether, benzene, chloroform miscible.

Preparation of Isopropyl bromide:
Isopropyl bromide is commercially available.
Isopropyl bromide may be prepared in the ordinary manner of alkyl bromides, by reacting isopropanol with phosphorus and bromine, or with phosphorus tribromide.

Production Method of Isopropyl bromide:
From isopropyl alcohol and hydrobromic acid reaction.
Slowly add isopropyl alcohol into concentrated sulfuric acid under cooling, control the temperature below 30 ℃, add hydrobromic acid after adding, slowly heat and reflux for 4H, and then distill the appearance of oil droplets, the obtained crude product was washed with concentrated sulfuric acid, water and 5% sodium carbonate respectively, then dried, filtered and fractionated with anhydrous sodium carbonate, and the 58.5-60.5 ° C.

Fraction was collected as the finished product.
In addition, there is an isopropyl alcohol-sodium bromide method.
The preparation method is derived from the reaction of isopropyl alcohol and hydrobromic acid.

The reaction equation is as follows:
(CH3)2CHOH + HBr[H2SO4]→(CH3)2CHBr + H2O

Isopropanol is slowly added to concentrated sulfuric acid under cooling, and the temperature is controlled below 30 ℃, after the addition, hydrobromic acid was added, and the mixture was slowly heated and refluxed for 4 h, then distilled until oil droplets appeared.
The crude product was washed with concentrated sulfuric acid, water and 5% sodium carbonate respectively, and then dried with anhydrous sodium carbonate, filtration, fractionation, collection of 58.5~60.5 °c fraction, that is, the finished product.

MeSH Pharmacological Classification of Isopropyl bromide:

Solvents:
Liquids that dissolve other substances (solutes), generally solids, without any change in chemical composition, as, water containing sugar.

Mutagens:
Chemical agents that increase the rate of genetic mutation by interfering with the function of nucleic acids.
A clastogen is a specific mutagen that causes breaks in chromosomes.

Stability and Reactivity of Isopropyl bromide:

Reactive Hazard:
None known, based on information available

Stability:
Stable under normal conditions.

Conditions to Avoid:
Incompatible products.
Excess heat.
Keep away from open flames, hot surfacesandsources of ignition.

Incompatible Materials:
Strong oxidizing agents, Strong bases

Hazardous Decomposition Products:
Carbon monoxide (CO), Carbon dioxide (CO2)

Hazardous Polymerization:
Hazardous polymerization does not occur.

Hazardous Reactions:
None under normal processing

Handling and Storage of Isopropyl bromide:

Handling:
Use only under a chemical fume hood.
Wear personal protective equipment/faceprotection.

Do not get in eyes, on skin, or on clothing.
Keep away from open flames, hot surfaces and sources of ignition.

Use only non-sparking tools.
Use spark-proof tools and explosion-proof equipment.

Do not breathe (dust, vapor, mist, gas).
Do not ingest.

If swallowed then seek immediate medical assistance.
Take precautionary measures against static discharges.
To avoid ignition of vapors by static electricity discharge, all metal parts of the equipment mustbe grounded.

Storage:
Keep containers tightly closed in a dry, cool and well-ventilated place.
Keep away from heat, sparks and flame.

Storage Conditions:
Materials which are toxic as stored or which can decompose into toxic components should be stored in a cool, well ventilated place, out of the direct rays of the sun, away from areas of high fire hazard, and should be periodically inspected.
Incompatible materials should be isolated.

Safety of Isopropyl bromide:
Short-chain alkyl halides are often carcinogenic.

The bromine atom is at the secondary position, which allows the molecule to undergo dehydrohalogenation easily to give propene, which escapes as a gas and can rupture closed reaction vessels.
When this reagent is used in base catalyzed reactions, potassium carbonate should be used in place of sodium or potassium hydroxide.

Fire Fighting Procedures of Isopropyl bromide:

If material on fire or involved in fire:
Do not extinguish fire unless flow can be stopped.
Use water in flooding quantities as fog.

Solid streams of water may be ineffective.
Cool all affected containers with flooding quantities of water.

Use alcohol foam, dry chemical or carbon dioxide.
Keep run-off water out of sewers and water sources.

Accidental Release Measures of Isopropyl bromide:

Disposal Methods of Isopropyl bromide:
At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision.
Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

Preventive Measures of Isopropyl bromide:

If material on fire or involved in fire:
Do not extinguish fire unless flow can be stopped.
Use water in flooding quantities as fog.

Solid streams of water may be ineffective.
Cool all affected containers with flooding quantities of water.

Use alcohol foam, dry chemical or carbon dioxide.
Keep run-off water out of sewers and water sources.

Personnel protection:
Avoid breathing vapors.
Do not handle broken packages unless wearing appropriate personal protective equipment.
If contact with the material anticipated, wear appropriate chemical protective clothing.

Identifiers of Isopropyl bromide:
CAS Number: 75-26-3
Beilstein Reference: 741852
ChEMBL: ChEMBL451810
ChemSpider: 6118
ECHA InfoCard: 100.000.778
EC Number: 200-855-1
PubChem CID: 6358
RTECS number: TX4111000
UNII: R651XOV97Z
UN number: 2344
CompTox Dashboard (EPA): DTXSID7030197
InChI: InChI=1S/C3H7Br/c1-3(2)4/h3H,1-2H3
Key: NAMYKGVDVNBCFQ-UHFFFAOYSA-N
SMILES: CC(C)Br

Catalogue Number: B687191
CAS Number: 220505-11-3
Molecular Formula: ¹³C₃H₇Br
Molecular Weight: 125.97

Properties of Isopropyl bromide:
Chemical formula: C3H7Br
Molar mass: 122.993 g·mol−1
Appearance: Colorless liquid
Density: 1.31 g mL−1
Melting point: −89.0 °C; −128.1 °F; 184.2 K
Boiling point: 59 to 61 °C; 138 to 142 °F; 332 to 334 K
Solubility in water: 3.2 g L−1 (at 20 °C)
log P: 2.136
Vapor pressure: 32 kPa (at 20 °C)
Henry's law
constant (kH): 1.0 μmol Pa−1 mol−1
Refractive index (nD): 1.4251
Viscosity: 0.4894 mPa s (at 20 °C)

Physical State Liquid
Appearance: Colorless, Light brown
Odor: Odorless
Odor Threshold: No information available
pH: No information available
Melting Point/Range: -89 °C / -128.2 °F
Boiling Point/Range: 59 °C / 138.2 °F @ 760 mmHg
Flash Point: 1 °C / 33.8 °F
Evaporation Rate: No information available
Flammability (solid,gas): Not applicable
Flammability or explosive limits:
Upper: No data available
Lower: 4.6 vol %
Vapor Pressure: 224 mbar @ 20 °C
Vapor Density: No information available
Specific: Gravity 1.310
Solubility: No information available
Partition coefficient; n-octanol/water: No data available
Autoignition: Temperature No information available
Decomposition: Temperature 251 °C
Viscosity: No information available
Molecular Formula: C3 H7 Br
Molecular Weight: 122.99

Physical State: Liquid
Usage: Commerical
Purity: 99% min
Boiling Point: 58-60degree C
Moisture: 0.5% max
Density: 1.31(w/w)

Molecular Weight: 122.99
XLogP3-AA: 1.8
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 0
Rotatable Bond Count: 0
Exact Mass: 121.97311
Monoisotopic Mass: 121.97311
Topological Polar Surface Area: 0 Ų
Heavy Atom Count: 4
Complexity: 10.8
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes

Specifications of Isopropyl bromide:
Product Name: ISO Propyl Bromide/(2 Bromopropane)
Cas No: 75-26-3
Assay: 99% MIN
Test: Standard
Colour: Colourless liquid
Density: 1.31(w/w)
Moisture: 0.5% max
Boiling Point: 58-60°C
Purity: 99% min

Appearance (Clarity): Clear
Appearance (Colour): Colourless to pale yellow
Appearance (Form): Liquid
Colour (APHA): max. 30
Assay (GC): min. 99%
Density (g/ml) @ 20°C: 1.305-1.315
Refractive Index (20°C): 1.424-1.425
Boiling Range: 58-60°C
Stabilizer (Ag wire): Present

Thermochemistry of Isopropyl bromide:
Heat capacity (C): 135.6 J K mol−1
Std enthalpy of formation (ΔfH⦵298): −129 kJ mol−1
Std enthalpy of combustion (ΔcH⦵298): −2.0537–−2.0501 MJ mol−1

Related compounds of Isopropyl bromide:

Related alkanes:
Bromoethane
1-Bromopropane
tert-Butyl bromide
1-Bromobutane
2-Bromobutane

Related Products of Isopropyl bromide:
Hydroxynorketamine-d6 Hydrochloride
(S)-Ketamine-d6 Hydrochloride
Norketamine-d4
S-(-)-Norketamine-d6 Hydrochloride
Phencyclidine-d5 Hydrochloride

Names of Isopropyl bromide:

Preferred IUPAC name:
2-Bromopropane

Other name:
Isopropyl bromide

Synonyms of Isopropyl bromide:
2-Bromopropane
75-26-3
ISOPROPYL BROMIDE
Propane, 2-bromo-
Isopropylbromide
2-BROMO-PROPANE
sec-Propyl bromide
2-bromo propane
UN2344
R651XOV97Z
MFCD00000147
CCRIS 7919
HSDB 623
EINECS 200-855-1
UNII-R651XOV97Z
i-propylbromide
AI3-18127
2-brompropan
iso-propylbromide
i-propyl bromide
2-bromanylpropane
2-propyl bromide
1-isopropylbromide
iso-propyl bromide
i-PrBr
iso-C3H7Br
1-bromo-1-methylethane
2-Bromopropane, 99%
EC 200-855-1
2-Bromopropane [UN2344] [Flammable liquid]
2-Bromopropane, >=99%
SCHEMBL10251
ISOPROPYL BROMIDE [MI]
CHEMBL451810
DTXSID7030197
2-Bromopropane, analytical standard
AMY37129
ZINC2041293
Tox21_200356
BBL027287
BR1118
STL146524
AKOS000119846
UN-2344
CAS-75-26-3
NCGC00091451-01
NCGC00091451-02
NCGC00257910-01
VS-08520
2-Bromopropane, purum, >=99.0% (GC)
B0639
FT-0611602
EN300-20069
D87619
A838364
Q209323
J-508539
F0001-1897

MeSH Entry Terms of Isopropyl bromide:
2-bromopropane
isopropyl bromide

DESCRIPTION:
CAS: 5080-22-8
European Community (EC) Number: 225-791-1
IUPAC Name: N-propan-2-ylhydroxylamine
Molecular Formula: C3H9NO


CHEMICAL AND PHYSICAL PROPERTIES OF ISOPROPYL HYDROXYLAMINE IPHA:
Molecular Weight 75.11
XLogP3-AA 0.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 75.068413911
Monoisotopic Mass 75.068413911
Topological Polar Surface Area 32.3 Ų
Heavy Atom Count 5
Formal Charge 0
Complexity 20.9
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes
Product Name: N-Isopropyl Hydroxylamine (IPHA)
Synonyms: N-isopropylhydroxylamine; 5080-22-8; 2-Propanamine, N-hydroxy-; N-(propan-2-yl)hydroxylamine; N-hydroxypropan-2-amine; N-Isopropylhydroxylamine oxalate salt; N-hydroxypropan-2-amine; N-hydroxypropan-2-amine sulfate (2:1)
CAS NO.: 5080-22-8
EINECS No.: 225-791-1
Molecular Formula: (CH3)2CHNH(OH)
Package: 170 kg plastic lined iron drum
Molecular weight: 75.11
Flashing point: ≥95°C
Density: 1 g/ml
Refractive power: 1.3570
Freezing point: -3°C
PH: 10.6-11.2
Appearance: Clear liquid / White powder
Color: ≤ 200
Purity( ≥ %): 15
Moisture(≤ %): 85
Classification: Textile Auxiliary Agents
Cas NO.: 5080-22-8
Name: N-Isopropylhydroxylamine
Molecular Formula: C3H9NO
Melting Point: 159℃
Boiling Point: 104.9°Cat760mmHg
Refractive index:1.411 (Predicted)
Flash Point: 44.5°C
Purity: 15%
usage: a: used as ethylene monomer b: used as high effective restrainer c: very excellent termina
Density 0.9±0.1 g/cm3
Boiling Point 104.9±23.0 °C at 760 mmHg
Melting Point 159ºC
Molecular Formula C3H9NO
Molecular Weight 75.110
Flash Point 44.5±13.2 °C
Exact Mass 75.068413
PSA 32.26000
LogP 0.40
Vapour Pressure 16.5±0.4 mmHg at 25°C
Index of Refraction 1.411

APPLICATIONS OF N-ISOPROPYL HYDROXYLAMINE (IPHA):
ISOPROPYL HYDROXYLAMINE IPHA is Highly efficient short stopping agent for free radical emulsion polymerization reactions.
ISOPROPYL HYDROXYLAMINE IPHA is An effective oxygen scavenger/passivating agent in boiled water treatment applications.
ISOPROPYL HYDROXYLAMINE IPHA is A hydrazine alternative.





SAFETY INFORMATION ABOUT ISOPROPYL HYDROXYLAMINE IPHA:
First aid measures:
Description of first aid measures:
General advice:
Consult a physician.
Show this safety data sheet to the doctor in attendance.
Move out of dangerous area:

If inhaled:
If breathed in, move person into fresh air.
If not breathing, give artificial respiration.
Consult a physician.
In case of skin contact:
Take off contaminated clothing and shoes immediately.
Wash off with soap and plenty of water.
Consult a physician.

In case of eye contact:
Rinse thoroughly with plenty of water for at least 15 minutes and consult a physician.
Continue rinsing eyes during transport to hospital.

If swallowed:
Do NOT induce vomiting.
Never give anything by mouth to an unconscious person.
Rinse mouth with water.
Consult a physician.

Firefighting measures:
Extinguishing media:
Suitable extinguishing media:
Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide.
Special hazards arising from the substance or mixture
Carbon oxides, Nitrogen oxides (NOx), Hydrogen chloride gas

Advice for firefighters:
Wear self-contained breathing apparatus for firefighting if necessary.
Accidental release measures:
Personal precautions, protective equipment and emergency procedures
Use personal protective equipment.

Avoid breathing vapours, mist or gas.
Evacuate personnel to safe areas.

Environmental precautions:
Prevent further leakage or spillage if safe to do so.
Do not let product enter drains.
Discharge into the environment must be avoided.

Methods and materials for containment and cleaning up:
Soak up with inert absorbent material and dispose of as hazardous waste.
Keep in suitable, closed containers for disposal.

Handling and storage:
Precautions for safe handling:
Avoid inhalation of vapour or mist.

Conditions for safe storage, including any incompatibilities:
Keep container tightly closed in a dry and well-ventilated place.
Containers which are opened must be carefully resealed and kept upright to prevent leakage.
Storage class (TRGS 510): 8A: Combustible, corrosive hazardous materials

Exposure controls/personal protection:
Control parameters:
Components with workplace control parameters
Contains no substances with occupational exposure limit values.
Exposure controls:
Appropriate engineering controls:
Handle in accordance with good industrial hygiene and safety practice.
Wash hands before breaks and at the end of workday.

Personal protective equipment:
Eye/face protection:
Tightly fitting safety goggles.
Faceshield (8-inch minimum).
Use equipment for eye protection tested and approved under appropriate government standards such as NIOSH (US) or EN 166(EU).

Skin protection:
Handle with gloves.
Gloves must be inspected prior to use.
Use proper glove
removal technique (without touching glove's outer surface) to avoid skin contact with this product.
Dispose of contaminated gloves after use in accordance with applicable laws and good laboratory practices.
Wash and dry hands.

Full contact:
Material: Nitrile rubber
Minimum layer thickness: 0.11 mm
Break through time: 480 min
Material tested:Dermatril (KCL 740 / Aldrich Z677272, Size M)
Splash contact
Material: Nitrile rubber
Minimum layer thickness: 0.11 mm
Break through time: 480 min
Material tested:Dermatril (KCL 740 / Aldrich Z677272, Size M)
It should not be construed as offering an approval for any specific use scenario.

Body Protection:
Complete suit protecting against chemicals, The type of protective equipment must be selected according to the concentration and amount of the dangerous substance at the specific workplace.
Respiratory protection:
Where risk assessment shows air-purifying respirators are appropriate use a fullface respirator with multi-purpose combination (US) or type ABEK (EN 14387) respirator cartridges as a backup to engineering controls.

If the respirator is the sole means of protection, use a full-face supplied air respirator.
Use respirators and components tested and approved under appropriate government standards such as NIOSH (US) or CEN (EU).
Control of environmental exposure
Prevent further leakage or spillage if safe to do so.
Do not let product enter drains.
Discharge into the environment must be avoided.

Stability and reactivity:
Chemical stability:
Stable under recommended storage conditions.
Incompatible materials:
Strong oxidizing agents:
Hazardous decomposition products:
Hazardous decomposition products formed under fire conditions.
Carbon oxides, Nitrogen oxides (NOx), Hydrogen chloride gas.

Disposal considerations:
Waste treatment methods:
Product:
Offer surplus and non-recyclable solutions to a licensed disposal company.
Contact a licensed professional waste disposal service to dispose of this material.
Contaminated packaging:
Dispose of as unused product.






SYNONYMS OF ISOPROPYL HYDROXYLAMINE IPHA:
2-hydroxylaminopropane
2-hydroxylaminopropane sulfate (2:1)
N-isopropylhydroxylamine
5080-22-8
2-Propanamine, N-hydroxy-
n-hydroxypropan-2-amine
N-propan-2-ylhydroxylamine
ISOPROPYLHYDROXYLAMINE
DTXSID6063694
3NT440V34T
N-(propan-2-yl)hydroxylamine
2-Hydroxylaminopropane
N-Hydroxyisopropylamine
UNII-3NT440V34T
EINECS 225-791-1
IPHA
isopropyl hydroxylamine
N-Isopropyl-hydroxylamine
N-Isopropylhydroxylamine #
EC 225-791-1
ISOPROPYL HYDROXYAMINE
CHEMBL140282
N-HYDROXY-2-PROPANAMINE
N-HYDROXY-2-PROPANEAMINE
HYDROXYLAMINE, N-ISOPROPYL-
ZINC1677558
MFCD02874394
AKOS006230300
AT14836
FT-0719142
EN300-112062
Q27257766
N-ISOPROPYLHYDROXYLAMINE (15% SOLUTION IN WATER)
Z1198161074
n-isopropylhydroxylamine;n-hydroxypropan-2-amine;2-propanamine, n-hydroxy-;2-hydroxylaminopropane;n-isopropylhydroxylamine n-hydroxypropan-2-amine 2-propanamine, n-hydroxy- 2-hydroxylaminopropane

Isopropyl isostearate is a useful research compound.
Isopropyl isostearate's molecular formula is C21H42O2 and its molecular weight is 326.6 g/mol.


CAS Number: 31478-84-9 / 68171-33-5
EC Number: 250-651-1 / 269-023-3
MDL Number: MFCD00038718
Chem/IUPAC Name: Isopropyl isodecanoate
Molecular Formula: C21H42O2



Isopropyl isostearate, 68171-33-5, Nikkol IPIS, Wickenol 131, 31478-84-9, Isopropyl 16-methylheptadecanoate, propan-2-yl 16-methylheptadecanoate,
Isooctadecanoic acid, 1-methylethyl ester, C67IXB9Y7T, 2-Propyl isooctadecanoate, Isostearic acid, isopropyl ester, 1-Methylethyl isooctadecanoate,
Isopropyl isodecanoate, EINECS 250-651-1, ISOPROPYLISOSTEARATE, UNII-C67IXB9Y7T, EINECS 269-023-3, IPIS, CRODAMOL IPIS, DERMOL IPIS, JEECHEM IPIS, NIKKOL EPIS, UNIMATE IPIS, MATLUBE II, DUB ISIP, SCHERCEMOL 318, LANESTA 10, EC 269-023-3, PRISORINE 2021, WITCONOL 2310, SCHERCEMOL 318 ESTER, Heptadecanoic acid, 16-methyl-, 1-methylethyl ester, isostearic acid isopropyl ester, PRISORINE IPIS 2021, SCHEMBL8088310, AEC ISOPROPYL ISOSTEARATE, DTXSID101015768, i-Propyl 16-methyl-heptadecanoate, ISOPROPYL ISOSTEARATE [II], ISOPROPYL ISOSTEARATE [INCI], ISOPROPYL ISOSTEARATE [USP-RS], ISOPROPYL ISOSTEARATE [WHO-DD], ISOPROPYL ISOSTEARATE [EP MONOGRAPH], FT-0641164, NS00008061, Q27275243, Isopropyl Isostearate, T/N Unipro IPIS, TN: Dermol IPIS, Jeechem IPIS, 1-Methylethyl isooctadecanoate, Unipro IPIS, Nikkol IPIS, Wickenol 131, nikkolipis,wickenol131,Einecs 250-651-1,ISOPROPYL ISOSTEARATE,isopropyl isodecanoate,2-Propylisooctadecanoate,Isopropyl isostearate CRS,1-methylethylisooctadecanoate,Isostearicacid,isopropylester,propan-2-yl 16-methylheptadecanoate, Isostearic acid, isopropyl ester,1-Methylethyl isooctadecanoate,Isooctadecanoic acid,1-methylethyl ester,Nikkol IPIS,2-Propyl isooctadecanoate,Prisorine IPIS 2021,propan-2-yl 16-methylheptadecanoate,Unimate IPIS,Isooctadecanoic acid, 1-methylethyl ester,Wickenol 131,HEPTADECANOIC ACID, 16-METHYL-, ISOPROPYL ESTER, Isopropyl 16-Methylheptadecanoate, Isostearic Acid, Isopropyl Ester, Propan-2-yl 16-Methylheptadecanoate,
Isopropyl isostearate,Heptadecanoic acid, 16-methyl-, isopropyl ester, Isooctadecanoic acid, 1-methylethyl ester, Isopropyl isodecanoate



Isopropyl isostearate is a synthetic ingredient very commonly used in cosmetics and personal care products.
Isopropyl isostearate appears as a clear, colorless liquid that belongs to the ester family.
Primarily, Isopropyl isostearate acts as a lubricant, providing a smooth and silky texture to products.


Isopropyl isostearate also functions as an emollient, helping to soften and moisturize the skin.
Additionally, Isopropyl isostearate can enhance the spreadability of formulations, allowing them to be easily applied and absorbed.
Due to its lightweight and non-greasy nature, Isopropyl isostearate is often used in lotions, creams, serums, and makeup products.


The chemical formula of Isopropyl isostearate is C21H42O2.
Isopropyl isostearate is an Ester of isopropyl alcohol and isostearic acid.
The exact mass of Isopropyl isostearate is unknown and the complexity rating of the compound is unknown.


Isopropyl isostearate is an oily liquid (ester) that makes your skin nice and smooth, aka emollient.
Isopropyl isostearate is described as highly emollient or substantive, but with a light and easy spreading and nonoily skin feel.
Isopropyl isostearate is a lipid synthesized via a reaction between isopropyl alcohol and isostearic acid, a type of fatty acid.


Isopropyl isostearate is the ester of isopropyl alcohol.
Isopropyl isostearate is an organic compound formed by the reaction of an acid with an alcohol.
Alcohols are a large class of important cosmetic ingredients but only ethanol needs to be denatured to prevent Isopropyl isostearate from being redirected from cosmetic applications to alcoholic beverages.


Isopropyl isostearate is a liquid.
Isopropyl isostearate is fatty ester derived from renewable vegetable oils.
Saponification value of Isopropyl isostearate is 160-180.


Isopropyl isostearate is a colorless to light yellow oily liquid
Isopropyl isostearate is a colorless to slightly yellow transparent liquid
Isopropyl isostearate is an emollient that leaves the skin surface with a smooth and supple finish.


Isopropyl isostearate also acts as a binder.
Isopropyl isostearate is a derivative of isostearic acid.
Isopropyl isostearate is a non flammable.



USES and APPLICATIONS of ISOPROPYL ISOSTEARATE:
Isopropyl isostearate is used Cosmetics -> Binding; Emollient; Skin conditioning.
Isopropyl isostearate uses and applications include: Emollient, lubricant, solubilizer for bath oils, creams, lotions, shampoos; binder for pressed powder; emollient, emulsifier, thickener, stabilizer, opacifier, pearlescent for creams, shaving creams, cream shampoos.


Isopropyl isostearate has many uses in the personal care and cosmetic industry.
Isopropyl isostearate is a great emollient that provides intense moisturization and hydration to the skin.
Isopropyl isostearate also forms a protective barrier that helps prevent water loss, keeping the skin soft and supple.


Because it is lightweight and non-greasy, Isopropyl isostearate does not feel heavy on the surface of the skin and lets it breathe.
In products like creams, serums, and lotions, Isopropyl isostearate improves the spreadability and absorption to allow for an easier application and a smooth finish.


Isopropyl isostearate is also added to makeup formulations such as foundations, lipsticks, and eyeshadows, where it enhances the blend-ability and adherence of the products.
In cosmetics and personal care products, Isopropyl isostearate is used in the formulation of skin care products and face and eye makeup.


Isopropyl isostearate is a fast spreading emollient suitable for all cosmetic applications.
Isopropyl isostearate is the ester of isopropyl alcohol and isostearic acid.
Isopropyl isostearate is used as a skin-softening agent and emollient in cosmetics products, retaining none of the sensitizing potential pure isopropyl alcohol has.


Isopropyl isostearate is a liquid, non-ionic emollient derived from isostearic acid that offers superb moisturization characteristics.
This light, easy-spreading emollient, Isopropyl isostearate, is particularly suited to face creams and other applications where skin moisturization is of high importance.


As a highly effective makeup solvent, Isopropyl isostearate also has outstanding performance in makeup removers and foundations.
Isopropyl isostearate is a low viscosity, fast spreading emollient.
Isopropyl isostearate finds application in formulating antiperspirants, deodorants, baby-care & cleansers, facial- & body-care products, color-care and sun-care (sun-protection, after-sun & self-tanning) products.


Recommended use level of Isopropyl isostearate is 1-5%.
Isopropyl isostearate is used for external use only.
Isopropyl isostearate offers good moisturizing, long-lasting and lubricious skin feel.


Isopropyl isostearate is a good solvent for makeup removers and foundations.
Isopropyl isostearate is used as a binder for decorative cosmetics.
Isopropyl isostearate offers excellent low temperature properties and exhibit good oxidative stability, due to the saturated and branched molecular structure.


Isopropyl isostearate has remarkably high miscibility and compatibility in a wide range of formulations with ester oils, silicone-based emulsifiers and color pigments.
Isopropyl isostearate is used Skin and hair care products, color cosmetics
Isopropyl isostearate is used Treatment / Conditioner, Milk / Cream / Serum, and Suncare


Isopropyl isostearate is used Lubrication of the skin, gives a soft and smooth appearance.
Isopropyl isostearate acts as a light-textured emollient with low occlusivity, good permeation and spreadability.
Cosmetic Uses of Isopropyl isostearate: binding agents, skin conditioning, and skin conditioning - emollient



FUNCTIONS OF ISOPROPYL ISOSTEARATE:
*Binding agent :
Isopropyl isostearate allows the cohesion of different cosmetic ingredients
*Emollient :
Isopropyl isostearate softens and smoothes the skin
*Skin conditioning :
Isopropyl isostearate maintains skin in good condition



ORIGIN OF ISOPROPYL ISOSTEARATE:
Isopropyl isostearate is typically made by esterifying isostearic acid with isopropyl alcohol.
This process involves combining the acid and alcohol in the presence of a catalyst, resulting in the formation of Isopropyl isostearate and water.
The reaction is then followed by purification steps to obtain the desired product.



SAFETY PROFILE OF ISOPROPYL ISOSTEARATE:
Isopropyl isostearate is considered safe for cosmetic use.
Isopropyl isostearate has a low comedogenic rating, so it is unlikely to cause acne and breakouts.



ALTERNATIVES OF ISOPROPYL ISOSTEARATE:
CAPRYLIC CAPRIC TRIGLYCERIDE,
ETHYLHEXYL PALMITATE,
DIMETHICONE



FUNCTION OF ISOPROPYL ISOSTEARATE:
Isopropyl isostearate is an emoliient that leaves the skin surface with a smooth and supple finish.
Isopropyl isostearate also acts as a binder.



FEATURES OF ISOPROPYL ISOSTEARATE:
*Low viscosity oil with light and dry feeling.
*Good solubilizing capacity of UV absorbers.
*Reduce frictions of damaged hair.



WHAT DOES ISOPROPYL ISOSTEARATE DO IN A FORMULATION?
*Binding
*Emollient
*Moisturising
*Skin conditioning



WHY IS ISOPROPYL ISOSTEARATE USED?
Isopropyl isostearate acts as a lubricant on the skin’s surface giving it a soft and smooth appearance.
Isopropyl isostearate may also act as a binder
Isopropyl isostearate is used ingredients that hold together the ingredients of a compressed tablet or cake.



SCIENTIFIC FACTS OF ISOPROPYL ISOSTEARATE:
Isopropyl isostearate is made from isopropyl alcohol and stearic acid.
Stearic acid is naturally occurring and is found in animal and vegetable fats.



FUNCTION OF ISOPROPYL ISOSTEARATE:
*An emollient
Isopropyl isostearate is the ester of Isopropyl Alcohol and Isostearic Acid(CosmeticsInfo.org).
Isopropyl isostearate is used in beauty products as an emollient, skin conditioning agent, binder and humectant.
Isopropyl isostearate helps lock in moisture and gives skin a smooth feel, and acts as a lubricant on the skin's surface to give it a soft and silky appearance.



PHYSICAL and CHEMICAL PROPERTIES of ISOPROPYL ISOSTEARATE:
Boiling Point: 360.7°C
Melting Point: 18.45°C
pH: Neutral
Solubility: Partially soluble in water
Viscosity: Low
Molecular Weight: 326.6 g/mol
XLogP3-AA: 9
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 2
Rotatable Bond Count: 17
Exact Mass: 326.318480578 g/mol

Monoisotopic Mass: 326.318480578 g/mol
Topological Polar Surface Area: 26.3Ų
Heavy Atom Count: 23
Formal Charge: 0
Complexity: 259
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes
Physical state: liquid

Color: No data available
Odor: No data available
Melting point/freezing point:
Melting point/freezing point: < 0 °C at ca.1.013 hPa
Initial boiling point and boiling range: No data available
Flammability (solid, gas): No data available
Upper/lower flammability or explosive limits: No data available
Flash point: No data available
Autoignition temperature: 240 °C at 1.001 - 1.012 hPa
Decomposition temperature: No data available
pH: No data available

Viscosity
Viscosity, kinematic: 13,138 mm2/s at 20 °C7,121 mm2/s at 40 °C
Viscosity, dynamic: No data available
Water solubility 0,0015 g/l at 20 °C
Partition coefficient: n-octanol/water: No data available
Vapor pressure: No data available
Density: No data available
Relative density: No data available
Relative vapor density: No data available
Particle characteristics: No data available
Explosive properties: Not classified as explosive.
Oxidizing properties: none
Other safety information: No data available

Chemical Class: Fatty Acid Esters , Polybasic Acid Esters
CAS Number: 31478-84-9
EINECS: 42-501013
Appearance: Colorless to light yellow liquid
Melting point: 18.45°C (estimate)
Boiling point: 364.57°C (rough estimate)
Density: 0.8760 (rough estimate)
refractive index: 1.4304 (estimate)
Viscosity: 13.14mm2/s
EWG's Food Scores: 1
FDA UNII: C67IXB9Y7T
EPA Substance Registry System: Isopropyl isostearate (68171-33-5)

Name:Isopropyl isostearate
EINECS: 269-023-3
CAS No.: 68171-33-5
Density: 0.86 g/cm3
PSA: 26.30000
LogP: 7.05540
Solubility: N/A
Melting Point: 18.45°C (estimate)
Formula: C21H42O2
Boiling Point: 360.7 °Cat760mmHg
Molecular Weight: 326.63
Flash Point: 183.6 °C
Transport Information: N/A
Appearance: N/A
Safety: Risk Codes: N/A

EINECS: 269-023-3
IUPAC Name: Propan-2-yl 16-methylheptadecanoate
Molecular Formula: C21H42O2
Molecular Weight: 326.556980 g/mol
XLogP3-AA: 9
H-Bond Acceptor: 2
Canonical SMILES: CC(C)CCCCCCCCCCCCCCC(=O)OC(C)C
InChI: InChI=1S/C21H42O2/c1-19(2)17-15-13-11-9-7-5-6-8-10-12-14-16-18-21(22)23-20(3)4/h19-20H,5-18H2,1-4H3
InChIKey: NEOZOXKVMDBOSG-UHFFFAOYSA-N
Index of Refraction: 1.445
Molar Refractivity: 101.03 cm3
Molar Volume: 379.4 cm3

Surface Tension: 29.8 dyne/cm
Density: 0.86 g/cm3
Flash Point: 183.6 °C
Enthalpy of Vaporization: 60.65 kJ/mol
Boiling Point: 360.7 °C at 760 mmHg
Vapour Pressure: 2.18E-05 mmHg at 25 °C
Water Solubility of Isopropyl isostearate (CAS NO. 68171-33-5): 0.000155 mg/L at 25 °C
Molecular form: C21H42O2
Appearance: NA
Mol. Weight: 326.57
Storage: 2-8°C Refrigerator
Shipping Conditions: Ambient
Applications: NA
BTM: NA



FIRST AID MEASURES of ISOPROPYL ISOSTEARATE:
-Description of first-aid measures:
*If inhaled:
If breathed in, move person into fresh air.
*In case of skin contact:
Wash off with soap and plenty of water.
*In case of eye contact:
Flush eyes with water as a precaution.
*If swallowed:
Never give anything by mouth.
Rinse mouth with water.
-Indication of any immediate medical attention and special treatment needed:
No data available



ACCIDENTAL RELEASE MEASURES of ISOPROPYL ISOSTEARATE:
-Environmental precautions:
No special environmental precautions required.
-Methods and materials for containment and cleaning up:
Keep in suitable, closed containers for disposal.



FIRE FIGHTING MEASURES of ISOPROPYL ISOSTEARATE:
-Extinguishing media:
*Suitable extinguishing media:
Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide.
-Further information:
No data available



EXPOSURE CONTROLS/PERSONAL PROTECTION of ISOPROPYL ISOSTEARATE:
-Control parameters:
--Ingredients with workplace control parameters:
-Exposure controls:
--Personal protective equipment:
*Eye/face protection:
Use equipment for eye protection.
*Skin protection:
Handle with gloves.
Wash and dry hands.
*Body Protection:
Impervious clothing.
*Respiratory protection:
Respiratory protection not required.
-Control of environmental exposure:
No special environmental precautions required.



HANDLING and STORAGE of ISOPROPYL ISOSTEARATE:
-Conditions for safe storage, including any incompatibilities:
*Storage conditions:
Keep container tightly closed in a dry and well-ventilated place.
Store in cool place.
*Storage class:
Storage class (TRGS 510): 12:
Non Combustible Liquids



STABILITY and REACTIVITY of ISOPROPYL ISOSTEARATE:
-Reactivity:
No data available
-Chemical stability:
Stable under recommended storage conditions.
-Possibility of hazardous reactions:
No data available
-Conditions to avoid:
No data available

ISOPROPYL LAURATE, N° CAS : 10233-13-3. Nom INCI : ISOPROPYL LAURATE. N° EINECS/ELINCS : 233-560-1. Ses fonctions (INCI) : Agent fixant : Permet la cohésion de différents ingrédients cosmétiques. Emollient : Adoucit et assouplit la peau. Agent d'entretien de la peau : Maintient la peau en bon état

Isopropyl laurate,Laurate d’isopropyle, IPL,Dodecanoic acid, 1-methylethyl ester, EC / List no.: 233-560-1, CAS no.: 10233-13-3. Mol. formula: C15H30O2 Le Laurate d’isopropyle est produit à partir d’acide laurique dérivé d’huile végétale & d’isopropanol (ou alcool isopropylique). C’est l’ester de l’acide laurique et de l’isopropanol.1-Methylethyl dodecanoate; 233-560-1 [EINECS]; Dodecanoic acid, 1-methylethyl ester ; Isopropyl laurate ; Isopropyllaurat [German] ; Laurate d'isopropyle [French] MFCD00451146 [MDL number]; propan-2-yl dodecanoate; [10233-13-3]; 2-Propanoldodecanoate; 56S; 98-58-8 [RN]; AGN-PC-0JKHZX; Dodecanoic acid 1-methylethyl ester; dodecanoic acid isopropyl ester; Dodecanoic acid methylethyl ester; EINECS 233-560-1; iso-Propyl dodecanoate; Isopropyl dodecanoate; Isopropyl laurate|Propan-2-yl dodecanoate; Isopropyl_laurate; iso-Propyldodecanoate; Isopropyllaurate; Jsp000277; lauric acid isopropyl ester; ST-5309. Isopropyl laurate is used in the following products: washing & cleaning products, polymers, textile treatment products and dyes, adhesives and sealants, lubricants and greases, pH regulators and water treatment products and plant protection products.

Isopropyl Laurate is an ester of isopropyl alcohol and lauric acid.
Isopropyl Laurate is a versatile ingredient renowned for its roles as a solubilizer, emulsifier, and emollient.


CAS Number: 10233-13-3
EC Number: 233-560-1
MDL number: MFCD00451146
Chem/IUPAC Name: Isopropyl laurate
Molecular Formula: C15H30O2


Isopropyl Laurate is an ester of isopropyl alcohol and myristic acid (vegetable-derived).
Isopropyl Laurate has a low viscosity fluid non-greasy emollient, tolerates a wide pH range, compatible with most surfactants.
Thanks to its low viscosity and density, Isopropyl Laurate has a high spreadability.


The specific gravity of Isopropyl Laurate is 0.85 (at 20°C).
Isopropyl Laurate is a versatile ingredient renowned for its roles as a solubilizer, emulsifier, and emollient.
Isopropyl Laurate is registered under the REACH Regulation and is manufactured in and / or imported to the European Economic Area, at ≥ 1 000 to < 10 000 tonnes per annum.


Isopropyl Laurate is a fatty acid ester obtained by the formal condensation of carboxy group of dodecanoic acid with propan-2-ol. Isopropyl Laurate is a metabolite found in human saliva.
Isopropyl Laurate has a role as a human metabolite.


Isopropyl Laurate is a fatty acid ester and an isopropyl ester.
Isopropyl Laurate is functionally related to a dodecanoic acid.
Isopropyl Laurate is a natural product found in Lonicera japonica with data available.


Isopropyl Laurate is a colorless to pale yellow liquid, is insoluble in water, and has a faint odor.
Isopropyl Laurate is a fatty acid ester obtained by the formal condensation of carboxy group of dodecanoic acid with propan-2-ol.
Isopropyl Laurate has a role as a human metabolite.


Isopropyl Laurate is a fatty acid ester and an isopropyl ester.
Isopropyl Laurate derives from a dodecanoic acid.
Isopropyl Laurate is a non-branched saturated fatty acid ester obtained from isopropanol and lauric acid, from palm oil.
Isopropyl Laurate is a clear liquid with a melting point of 23 ºC.



USES and APPLICATIONS of ISOPROPYL LAURATE:
Isopropyl Laurate is used as a cosmetics deep agent and skin moisturizer, penetrant.
Isopropyl Laurate has excellent penetration, moisturizing and softening effect on the skin, and is used for emulsifiers and moisturizers for cosmetics.
Isopropyl Laurate can be used in cosmetics such as sol product, hair conditioner, skin cream, sunscreen and shaving cream.


Isopropyl Laurate is used by consumers, in articles, by professional workers (widespread uses), in formulation or re-packing, at industrial sites and in manufacturing.
Isopropyl Laurate is used in the following products: washing & cleaning products, polymers, textile treatment products and dyes, lubricants and greases, adhesives and sealants and pH regulators and water treatment products.


Release to the environment of Isopropyl Laurate can occur from industrial use: in the production of articles and in processing aids at industrial sites.
Other release to the environment of Isopropyl Laurate is likely to occur from: indoor use (e.g. machine wash liquids/detergents, automotive care products, paints and coating or adhesives, fragrances and air fresheners) and outdoor use.


Other release to the environment of Isopropyl Laurate is likely to occur from: indoor use in long-life materials with low release rate (e.g. flooring, furniture, toys, construction materials, curtains, foot-wear, leather products, paper and cardboard products, electronic equipment), outdoor use in long-life materials with low release rate (e.g. metal, wooden and plastic construction and building materials), indoor use (e.g. machine wash liquids/detergents, automotive care products, paints and coating or adhesives, fragrances and air fresheners) and outdoor use.


Isopropyl Laurate can be found in complex articles, with no release intended: vehicles.
Isopropyl Laurate can be found in products with material based on: plastic (e.g. food packaging and storage, toys, mobile phones), wood (e.g. floors, furniture, toys) and leather (e.g. gloves, shoes, purses, furniture).


Isopropyl Laurate is used in the following products: washing & cleaning products and polishes and waxes.
Isopropyl Laurate is used in the following areas: formulation of mixtures and/or re-packaging.
Isopropyl Laurate is used for the manufacture of: and chemicals.


Other release to the environment of Isopropyl Laurate is likely to occur from: indoor use (e.g. machine wash liquids/detergents, automotive care products, paints and coating or adhesives, fragrances and air fresheners) and outdoor use.
Isopropyl Laurate is used in the following products: polymers, washing & cleaning products, lubricants and greases and textile treatment products and dyes.


Release to the environment of Isopropyl Laurate can occur from industrial use: formulation of mixtures and formulation in materials.
Isopropyl Laurate is used in the following products: washing & cleaning products, metal surface treatment products, textile treatment products and dyes, polymers and lubricants and greases.


Isopropyl Laurate is used for the manufacture of: and chemicals.
Release to the environment of Isopropyl Laurate can occur from industrial use: in processing aids at industrial sites, in the production of articles and as processing aid.


Release to the environment of Isopropyl Laurate can occur from industrial use: manufacturing of the substance.
Release to the environment of Isopropyl Laurate can occur from industrial use: in the production of articles and formulation in materials.
Isopropyl Laurate is used in the following areas: formulation of mixtures and/or re-packaging.


Applications of Isopropyl Laurate: Creams, lotions, hand creams, shampoo, shower gels, makeup removers, powders and foundations.
Isopropyl Laurate uses and applications include: Emollient, lubricant, plasticizer, and cosolvent in cosmetics and pharmaceuticals; defoamer in food-contact paperpaperboard; in food-contact textiles


Widely embraced in cosmetics and topical medicine, Isopropyl Laurate finds applications in personal care and beauty care realms, including body care, facial care, hair care, lip care, and skincare.
Isopropyl Laurate's adaptability extends even further, serving as a flavoring agent in the food industry.


Cosmetic formulations of Isopropyl Laurate: binding, skin conditioning, emollient.
Industrial uses of Isopropyl Laurate: manufacturer of washing and cleaning products, polymers, textile treatment products and dyes, adhesives and sealants, lubricants and greases, pH regulators and water treatment products and plant protection products.


Isopropyl Laurate can be used as a flavor and fragrance agent.
Uses of Isopropyl Laurate: Processing aids, specific to petroleum production.
Isopropyl Laurate can be used as cosmetic oily raw materials, and Isopropyl Laurate can also be used as lubricant additives.


Isopropyl Laurate can also be used as a pharmaceutical excipient, as a solvent and penetration enhancer for topical drugs, instead of vegetable oil, as a lubricant and matrix, and used to prepare ointments and creams.


Isopropyl Laurate is recommended to be used in stamping oil solvents (air conditioning aluminum fin oil), base oils and additives for metalworking fluids, solvent-based cleaning agents and water-based cleaning fluids.
Isopropyl Laurate uses and applications include: Emollient, lubricant, plasticizer, and cosolvent in cosmetics and pharmaceuticals; defoamer in food-contact paperpaperboard; in food-contact textiles.



FUNCTIONS OF ISOPROPYL LAURATE:
*Binding agent :
Isopropyl Laurate allows the cohesion of different cosmetic ingredients
*Emollient :
Isopropyl Laurate softens and smoothes the skin
*Skin conditioning :
Isopropyl Laurate maintains skin in good condition
*Conditioner,
*Emollient,
*Re-Fatting Agent



WHAT DOES ISOPROPYL LAURATE DO IN A FORMULATION?
*Binding
*Emollient
*Skin conditioning



FOOD ADDITIVE CLASSES OF ISOPROPYL LAURATE:
*Flavoring Agents



PHYSICAL and CHEMICAL PROPERTIES of ISOPROPYL LAURATE:
CAS Number: 10233-13-3
Chem/IUPAC Name: Isopropyl laurate
EINECS/ELINCS No: 233-560-1
Molecular Weight: 242.40 g/mol
XLogP3-AA: 6.1
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 2
Rotatable Bond Count: 12
Exact Mass: 242.224580195 g/mol
Monoisotopic Mass: 242.224580195 g/mol
Topological Polar Surface Area: 26.3Ų
Heavy Atom Count: 17
Formal Charge: 0
Complexity: 176
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes

Appearance Form: liquid
Odor: No data available
Odor Threshold: No data available
pH: No data available
Melting point/freezing point: No data available
Initial boiling point and boiling range: No data available
Flash point: Not applicable
Evaporation rate: No data available
Flammability (solid, gas): No data available
Upper/lower flammability or explosive limits: No data available
Vapor pressure: No data available
Vapor density: No data available
Relative density: No data available
Water solubility: No data available
Partition coefficient: n-octanol/water:
log Pow: 6,178
Autoignition temperature: No data available
Decomposition temperature: No data available
Viscosity: No data available
Explosive properties: No data available
Oxidizing properties: No data available
Other safety information: No data available

Melting point: 4.2°C (estimate)
Boiling point: 285.23°C (estimate)
Density: 0.8536
refractive index: 1.4280
storage temp.: Sealed in dry,Room Temperature
form: liquid
color: Colourless
InChI: InChI=1S/C15H30O2/c1-4-5-6-7-8-9-10-11-12-13-15(16)17-14(2)3/h14H,4-13H2,1-3H3
InChIKey: UJPPXNXOEVDSRW-UHFFFAOYSA-N
SMILES: C(OC(C)C)(=O)CCCCCCCCCCC
LogP: 6.234 (est)
EPA Substance Registry System: Dodecanoic acid, 1-methylethyl ester (10233-13-3)
Molecular Weight： 242.39700
Exact Mass： 242.40
EC Number： 233-560-1
UNII： U0JQ94LABM
DSSTox ID： DTXSID3041904
HScode： 2915900090
PSA： 26.30000
XLogP3： 4.85890
Appearance： colourless oily liquid

Density： 0.865 g/cm3
Boiling Point： 196 °C
Flash Point： 125ºC
Refractive Index： 1.436
Vapor Pressure： 0.00358mmHg at 25°C
Molecular Weight:242.40
XLogP3:6.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:12
Exact Mass:242.224580195
Monoisotopic Mass:242.224580195
Topological Polar Surface Area:26.3
Heavy Atom Count:17
Complexity:176
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
IUPAC Name: Propan-2-yl tetradecanoate
Molecular Weight: 270.5

Molecular Formula: C17H34O2
Canonical SMILES: CCCCCCCCCCCCCC(=O)OC(C)C
InChI: InChI=1S/C17H34O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-17(18)19-16(2)3/h16H,4-15H2,1-3H3
InChI Key: AXISYYRBXTVTFY-UHFFFAOYSA-N
Boiling Point: 193 °C
Melting Point: 3 °C
Flash Point: >230 °F
Density: 0.85 g/mL at 25 °C(lit.)
Solubility: Water-insoluble, but soluble with silicones, and hydrocarbons
Appearance: Colorless oil-like liquid, odorless
Storage: Store in a closed container at a dry place at room temperature
Alpha Sort: Isopropyl myristate
Complexity: 199
Composition: Isopropyl myristate
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
EC Number: 203-751-4
Exact Mass: 270.255880323
Heavy Atom Count: 19

Hydrogen Bond Acceptor Count: 2
Hydrogen Bond Donor Count: 0
MDL Number: MFCD00008982
Monoisotopic Mass: 270.255880323
Odor: Practically odorless
Packing Group: I; II; III
Physical State: Liquid
Refractive Index: n20/D 1.434(lit.)
Rotatable Bond Count: 14
Safty Description: S26-S36
Stability: Stable.
Topological Polar Surface Area: 26.3 Ų
Vapor Pressure: 0.000329mmHg at 25°C
Viscosity: 4.8cp (25°C)
Appearance: Liquid
Melting point: 4.2°C (estimate)
Boiling point: 285.23°C (estimate)
Density: 0.8536



FIRST AID MEASURES of ISOPROPYL LAURATE:
-Description of first-aid measures:
*If inhaled:
If breathed in, move person into fresh air.
*In case of skin contact:
Wash off with soap and plenty of water.
*In case of eye contact:
Flush eyes with water as a precaution.
*If swallowed:
Rinse mouth with water.
-Indication of any immediate medical attention and special treatment needed:
No data available



ACCIDENTAL RELEASE MEASURES of ISOPROPYL LAURATE:
-Environmental precautions:
No special environmental precautions required.
-Methods and materials for containment and cleaning up:
Keep in suitable, closed containers for disposal.



FIRE FIGHTING MEASURES of ISOPROPYL LAURATE:
-Extinguishing media:
*Suitable extinguishing media:
Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide.
-Further information:
No data available



EXPOSURE CONTROLS/PERSONAL PROTECTION of ISOPROPYL LAURATE:
-Control parameters:
--Ingredients with workplace control parameters:
-Exposure controls:
--Appropriate engineering controls:
General industrial hygiene practice.
--Personal protective equipment:
*Eye/face protection:
Use equipment for eye protection.
*Skin protection:
Handle with gloves.
Wash and dry hands.
*Body Protection:
Impervious clothing.
*Respiratory protection:
Respiratory protection not required.
-Control of environmental exposure:
No special environmental precautions required.



HANDLING and STORAGE of ISOPROPYL LAURATE:
-Conditions for safe storage, including any incompatibilities:
Store in cool place.
Keep container tightly closed in a dry and well-ventilated place.



STABILITY and REACTIVITY of ISOPROPYL LAURATE:
-Reactivity:
No data available
-Chemical stability:
Stable under recommended storage conditions.
-Possibility of hazardous reactions:
No data available
-Conditions to avoid:
No data available



SYNONYMS:
Isopropyl dodecanoate
ISOPROPYL LAURATE
10233-13-3
propan-2-yl dodecanoate
Dodecanoic acid, 1-methylethyl ester
1-Methylethyl dodecanoate
U0JQ94LABM
MFCD00451146
WE(2:0(1Me)/12:0)
UNII-U0JQ94LABM
Isopropyl_laurate
iso-Propyl dodecanoate
EINECS 233-560-1
SCHEMBL44513
Isopropyl laurate, AldrichCPR
LEXOL IPL
DUB LAIP
EC 233-560-1
AEC ISOPROPYL LAURATE
dodecanoic acid isopropyl ester
DTXSID3041904
ISOPROPYL LAURATE [INCI]
CHEBI:89676
Dodecanoic acid methylethyl ester
UJPPXNXOEVDSRW-UHFFFAOYSA-N
LMFA07010674
AKOS014763161
CS-W002613
DS-2780
SY003934
FT-0696522
Q5971737
W-108876
(+)-TRANS-1,2-CYCLOHEXANEDICARBOXYLICANHYDRIDE
56S
ISOPROPYL LAURATE
1-Methylethyldodecanoate
Dodecanoic acid, 1-methylethyl ester
Dodecanoicacid,1-methylethylester
dodecanoicacidisopropylester
isopropyl
isopropyl dodecanoate
Dodecansyre, 1-methyl-ethyl-ester
1-METHYLETHYL DODECANOATE
AEC ISOPROPYL LAURATE
DODECANOIC ACID, 1-METHYLETHYL ESTER
DUB LAIP
ISOPROPYL DODECANOATE
ISOPROPYL LAURATE
ISOPROPYL LAURATE [INCI]
LEXOL IPL
Dodecanoic acid, 1-methylethyl ester
Lauric acid,isopropyl ester
Emcol-IL
Isopropyl laurate
Isopropyl dodecanoate
Dodecanoic acid isopropyl ester
1-Methylethyl dodecanoate
Loxanol MI 6460
Dodecanoic acid, 1-methylethyl ester
1-Methylethyl dodecanoate
iso-Propyl dodecanoate
propan-2-yl dodecanoate
1-Methylethyl dodecanoate
ISOPROPYL LAURATE
dodecanoicacidisopropylester
Dodecanoic acid, 1-methylethyl ester
Dodecanoicacid,1-methylethylester
Dodecanoic acid methylethyl ester
isopropyl
1-Methylethyldodecanoate
Dodecansyre, 1-methyl-ethyl-ester
Isopropyl dodecanoate

ISOPROPYL MYRISTATE; Tetradecanoic acid 1-methylethyl ester; Estergel; Myristic Acid, Isopropyl Ester; Bisomel; Tegester; Tetradecanoic Acid, Isopropyl; cas no: 110-27-0; 1405-98-7

ISOPROPYL MYRISTATE = IPM

Isopropyl myristate is the ester of isopropyl alcohol and myristic acid.
Isopropyl myristate mainly works as an emollient in cosmetics and personal care products.
Isopropyl myristate has an oily base with low viscosity and adapts well to the skin.

CAS number: 110-27-0
EC number: 203-751-4
Chemical Formula: C17H34O2
Molar Mass: 270.45 g/mol

Isopropyl myristate (IPM) is the ester of isopropyl alcohol and myristic acid.

Isopropyl myristate is a moisturizer with polar characteristics used in cosmetics and topical medical preparations to ameliorate the skin absorption.
Isopropyl myristate has been largely studied and impulsed as a skin penetration enhancer.
At the moment the primary usage for which isopropyl myristate is formally indicated is as the active ingredient in a non-prescription pediculicide rinse.

Isopropyl myristate is a natural product found in Siraitia grosvenorii, Mangifera indica, and other organisms with data available.
Isopropyl tetradecanoate is a fatty acid ester.

Isopropyl Myristate is composed of of isopropyl alcohol and myristic acid, a common, naturally occurring fatty acid.
Isopropyl myristate is a clear, colorless oil-like liquid that makes the skin feel smooth and nice (aka emollient) and Isopropyl Myristate does so without being greasy.

What's more, Isopropyl Myristate can even reduce the heavy, greasy feel in products with high oil content.
Isopropyl Myristate's also fast-spreading meaning that Isopropyl Myristate gives the formula a good, nice slip.
Isopropyl Myristate absorbs quickly into the skin and helps other ingredients to penetrate quicker and deeper.

Isopropyl myristate is a texture enhancer and emollient as used in cosmetics.
There is also research showing Isopropyl Myristate can help enhance the absorption of ingredients in a cosmetic formula.

Isopropyl myristate is often called out as being a particularly bad pore-clogging ingredient.
However, this assessment comes from dated research that doesn’t apply to how this ingredient is used in today’s cosmetics.

Isopropyl Myristate is a synthetic oil used as an emollient, thickening agent and lubricant in beauty and personal care products.
Isopropyl Myristate is composed of of Isopropyl Alcohol (a propane derivative) and Myristic Acid (a naturally-occurring fatty acid), Isopropyl Myristate is most often used an an additive in aftershaves, shampoos, bath oils, antiperspirants, deodorants, oral hygiene products, and various creams and lotions.

A unique characteristic of Isopropyl Myristate is Isopropyl Myristate ability to reduce the greasy feel caused by the high oil content of other ingredients in a product.
This synthetic oil is often added to beauty products to give them a slicker, sheer feel rather than an oily one.

Isopropyl Myristate is an emollient ester of low viscosity; the product of the reaction of isopropanol with myristic acid (vegetable source).
A non-greasy emollient, Isopropyl Myristate is readily adsorbed by the skin.

Miscible with most oils, Isopropyl Myristate imparts a dry, velvety emollience to products.
Isopropyl Myristate is used to reduce the greasiness of lotion bars, whipped butters and emulsions.

Isopropyl Myristate is resistant to oxidation and will not become rancid.
Isopropyl Myristate is also an effective diluent for fragrance oils.

Isopropyl myristate is an oily, clear, colorless, soluble liquid alcohol, oils, petrolatum and glycerine, insoluble in water.
Isopropyl Myristate is obtained by reacting myristic acid with isopropanol.

Isopropyl Myristate is an excellent vehicle because resistant to oxidation, Isopropyl Myristate is not rancid, also is not irritating or sensitizing and is rapidly absorbed by the skin without leaving any residue

Isopropyl Myristate has an emollient, moisturizing and protective action of the skin.
Isopropyl Myristate is incorporated in the fatty phase of the emulsions to enhance Isopropyl Myristate cosmetic appearance and enhance penetration of active ingredients.

Isopropyl myristate is a traditional, fast spreading emollient for modern cosmetic applications.
Isopropyl Myristate is a clear, colorless, almost odorless oil of medium polarity with a mean molecular weight, and a spreading value of approx. 1200 mm²/10 min.
Isopropyl Myristate has a saponification value of 205-211, a refractive index (20°C) of 1.4335-1.4355, and a density (20°C) of 0.850 – 0.855g/cm³.

Isopropyl Myristate is registered under the REACH Regulation and is manufactured in and / or imported to the European Economic Area, at ≥ 1 000 to < 10 000 tonnes per annum.
Isopropyl Myristate is used by consumers, in articles, by professional workers (widespread uses), in formulation or re-packing, at industrial sites and in manufacturing.

Applications of Isopropyl Myristate:
Isopropyl myristate is a texture enhancer and emollient as used in cosmetics.
Isopropyl Myristate can also help to enhance the absorption of ingredients in a cosmetic formula.

Skin care:
Isopropyl Myristate works as an emollient, thickener, and a lubricant in beauty products.
Isopropyl Myristate locks in the hydration, and enhances the penetration of other ingredients in the formulation.

Isopropyl myristate is an effective agent for solubilizing lanolin.
Therefore, isopropyl myristate is used as a solubilizing, spreading, and penetrating agent in anhydrous skin lubricating lotions with high lanolin content.

Isopropyl Myristate leaves the skin soft and smooth without an oily surface film.
Isopropyl Myristate can even reduce the heavy, greasy feel in products with high oil content.
Isopropyl Myristate's also fast-spreading meaning that Isopropyl Myristate gives the formula a good, nice slip

Hair care:
Isopropyl Myristate works as a hydrating agent, emollient, and enhancer.
Isopropyl Myristate hydrates the hair and the scalp and enhances the penetration of other ingredients in the formulation.
Isopropyl Myristate is not recommended for particularly thin hair, as Isopropyl Myristate can make it appear greasy, or an oily scalp or hair, as Isopropyl Myristate can lead to clogged pores.

Other Applications:
After Sun
Antiperspirants & Deodorants
Baby Care and Cleansing
Body Care
Color Care
Conditioning
Face Care
Face Cleansing
Personal Care Wipes
Self Tanning
Sun Protection

Uses of Isopropyl Myristate:
Isopropyl myristate is a polar emollient and is used in cosmetic and topical pharmaceutical preparations where skin absorption is desired.
Isopropyl Myristate is also used as a treatment for head lice.
Isopropyl Myristate is also in flea and tick killing products for pets.

Isopropyl Myristate is used to remove bacteria from the oral cavity as the non-aqueous component of the two-phase mouthwash product "Dentyl pH".
Isopropyl myristate is also used as a solvent in perfume materials, and in the removal process of prosthetic make-up.

Hydrolysis of the ester from isopropyl myristate can liberate the acid and the alcohol.
The acid is theorized to be responsible for decreasing of the pH value of formulations.

Isopropyl Myristate is used as emollient and emulsifier in cosmetics and topical medicines, parenteral solvent (intravenous solutions), and reagent in tests for sterility.
Isopropyl Myristate is used in cosmetic and topical medicinal preparations.

Isopropyl myristate is an effective agent for solubilizing lanolin; mixtures of up to about 50% lanolin in isopropyl myristate remain stable, free-flowing liquid at room temperature.
Therefore, isopropyl myristate is used as a solubilizing, spreading, and penetrating agent in anhydrous skin lubricating lotions with high lanolin content.

Isopropyl myristate leaves the skin soft and smooth without an oily surface film.
Isopropyl Myristate is used in bath oils, perfumes, creams lotions, lipsticks, hair preparations, shaving lotions, aerosol toiletries, and pharmaceutical ointments.

Widespread uses by professional workers:
Isopropyl Myristate is used in the following products: washing & cleaning products and polishes and waxes.
Isopropyl Myristate is used in the following areas: formulation of mixtures and/or re-packaging.

Isopropyl Myristate is used for the manufacture of: chemicals and .
Other release to the environment of Isopropyl Myristate is likely to occur from: indoor use (e.g. machine wash liquids/detergents, automotive care products, paints and coating or adhesives, fragrances and air fresheners) and outdoor use.

Uses at industrial sites:
Isopropyl Myristate is used in the following products: washing & cleaning products, metal surface treatment products and lubricants and greases.
Isopropyl Myristate is used in the following areas: formulation of mixtures and/or re-packaging.

Isopropyl Myristate is used for the manufacture of: chemicals and .
Release to the environment of Isopropyl Myristate can occur from industrial use: in processing aids at industrial sites and in the production of articles.

Industry Uses:
Defoamer
Diluent
Fragrance
Intermediate
Odor agents
Process regulators

Consumer Uses:
Isopropyl Myristate is used in the following products: washing & cleaning products, lubricants and greases, textile treatment products and dyes, adhesives and sealants, polymers and polishes and waxes.
Release to the environment of Isopropyl Myristate can occur from industrial use: in the production of articles.
Other release to the environment of Isopropyl Myristate is likely to occur from: indoor use (e.g. machine wash liquids/detergents, automotive care products, paints and coating or adhesives, fragrances and air fresheners) and outdoor use.

Other Consumer Uses:
Fragrance
Odor agents
Process regulators

Therapeutic Uses of Isopropyl Myristate:
Isopropyl myristate 50% in cyclomethicone solution is a new fluid treatment with a physical mode of action that uses a 10-minute contact time /for treatment of head lice.

A pediculicide rinse, 50% isopropyl myristate (IPM), was assessed in two phase 2 trials conducted in North America.
The first trial was a nonrandomized (proof of concept) trial without a comparator conducted in Winnipeg, Canada.

The second trial, conducted in the United States, was an evaluator-blinded, randomized superiority trial comparing 50% Isopropyl Myristate rinse with a positive control (RID; pyrethrin 0.33%, piperonyl butoxide 4%).
The primary end points were to determine the safety and efficacy of 50% Isopropyl Myristate as a pediculicide rinse.

METHODS:
Subjects meeting inclusion criteria were enrolled in the above-mentioned trials with efficacy end points 7 and 14 days post-treatment.
Subjects were also evaluated on days 0, 7, 14, and 21 for the presence of erythema and edema using the Modified Draize Scale.
Other comments associated with the safety evaluation (ie, pruritus) were collected.

RESULTS:
Isopropyl Myristate was found to be effective in the proof of concept study and comparator trial using a positive control.
Isopropyl Myristate was also well tolerated, with minimal adverse events.
All adverse events were mild, resolving by completion of the study.

CONCLUSION:
Data suggest that Isopropyl Myristate is a safe and effective therapy for the treatment of head lice in children and adults.
Isopropyl Myristate's mechanical mechanism of action makes development of lice resistance unlikely.

Drug Indication of Isopropyl Myristate:
The primary medical indication for which isopropyl myristate is formally used as an active ingredient in a patient care product is as a non-prescription pediculicide rinse.

Pharmacology and Biochemistry of Isopropyl Myristate:

Pharmacodynamics:
Isopropyl myristate is an emollient vehicle that is effective at enhancing the penetration of other medical agents that may be incorporated into the vehicle as active agents.
In one study, a 50:50 isopropanol-isopropyl myristate binary enhancer synergistically increased the transport of estradiol across a two-layer human epidermis in vitro.

Absorption, Distribution and Excretion of Isopropyl Myristate:

Absorption:
Dermal absorption of isopropyl myristate is predicated to be 0.00020 mg/cm2/event, which is considered a very low absorption rate.
In a study, topically applied isopropyl myristate was largely retained in the stratum corneum.
Isopropyl Myristate was not detected in the receptor fluid of flow-through diffusion cells in in-vitro skin permeation experiments using human epidermis (stratum corneum and viable epidermis) and dermis of varying thickness.

Action Mechanism of Isopropyl Myristate:
As a pediculicide, isopropyl myristate is capable of physically coating the exoskeleton bodies of lice.
This physical coating subsequently immobilizes the lice and works to dissolve the wax covering on the insect exoskeleton and blocks the insects' airways, leading to death by dehydration.

Although this physical action of isopropyl myristate results in little lice resistance (given the lack of immunologic or chemical activity in this mechanism of action), Isopropyl Myristate is also not ovicidal, which means any eggs that may have been laid by lice would not be affected.
Moreover, isopropyl myristate is capable of eliciting Isopropyl Myristate pediculicide action in a contact time of only 10 minutes per each necessary administration.

Human Metabolite Information of Isopropyl Myristate:

Cellular Locations:
Extracellular
Membrane

Manufacturing Methods of Isopropyl Myristate:
Isopropyl myristate is commercially produced by distillation, which is preceded by the esterification of myristic acid and isopropanol, alkali refined to neutralize the catalyst, and the product is then distilled to obtain isopropyl myristate.

General Manufacturing Information of Isopropyl Myristate:

Industry Processing Sectors:
All Other Chemical Product and Preparation Manufacturing
Asphalt Paving, Roofing, and Coating Materials Manufacturing
Not Known or Reasonably Ascertainable
Other (requires additional information)
Pesticide, Fertilizer, and Other Agricultural Chemical Manufacturing
Petrochemical Manufacturing
Plastics Material and Resin Manufacturing
Printing and Related Support Activities
Soap, Cleaning Compound, and Toilet Preparation Manufacturing

Accidental Release Measures of Isopropyl Myristate:

Disposal Methods:
Criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision.
Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

Identifiers of Isopropyl Myristate:
CAS Number: 110-27-0
ChEMBL: ChEMBL207602
ChemSpider: 7751
ECHA InfoCard: 100.003.412
EC Number: 203-751-4
KEGG: D02296
MeSH: C008205
PubChem CID: 8042
RTECS number: XB8600000
UNII: 0RE8K4LNJS
CompTox Dashboard (EPA): DTXSID0026838
InChI:
InChI=1S/C17H34O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-17(18)19-16(2)3/h16H,4-15H2,1-3H3
Key: AXISYYRBXTVTFY-UHFFFAOYSA-N
InChI=1/C17H34O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-17(18)19-16(2)3/h16H,4-15H2,1-3H3
Key: AXISYYRBXTVTFY-UHFFFAOYAN
SMILES: CCCCCCCCCCCCCC(=O)OC(C)C

EC / List no.: 203-751-4
CAS no.: 110-27-0
Mol. formula: C17H34O2

CAS number: 110-27-0
EC number: 203-751-4
Hill Formula: C₁₇H₃₄O₂
Molar Mass: 270.45 g/mol
Quality Level: MQ300

CAS Number: 110-27-0
Chem/IUPAC Name: Tetradecanoic acid, isopropyl ester
EINECS/ELINCS No: 203-751-4
COSING REF No: 34699

Synonym(s): Isopropyl myristate, Tetradecanoic acid isopropyl ester, Myristic acid isopropyl ester
Empirical Formula (Hill Notation): C17H34O2
CAS Number: 110-27-0
Molecular Weight: 270.45
MDL number: MFCD00008982
EC Index Number: 203-751-4

CAS: 110-27-0
Molecular Formula: C17H34O2
Molecular Weight (g/mol): 270.45
MDL Number: MFCD00008982
InChI Key: AXISYYRBXTVTFY-UHFFFAOYSA-N
PubChem CID: 8042
IUPAC Name: propan-2-yl tetradecanoate
SMILES: CCCCCCCCCCCCCC(=O)OC(C)C

Properties of Isopropyl Myristate:
Chemical formula: C17H34O2
Molar mass: 270.457 g·mol−1
Density: 0.85 g/cm3
Boiling point: 167 °C (333 °F; 440 K) at 9 mmHg

Boiling point: 140 °C (3 hPa)
Density: 0.85 g/cm3 (20 °C)
Flash point: >150 °C
Ignition temperature: >300 °C
Vapor pressure: Solubility:
Quality Level: 500
Vapor pressure: Form: liquid
Autoignition temp.: >300 °C
bp: 140 °C/3 hPa
Transition temp: flash point >150 °C
Density: 0.85 g/cm3 at 20 °C
Storage temp.: 15-25°C
InChI: 1S/C17H34O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-17(18)19-16(2)3/h16H,4-15H2,1-3H3
InChI key: AXISYYRBXTVTFY-UHFFFAOYSA-N

Molecular Weight: 270.5
XLogP3-AA: 7.2
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 2
Rotatable Bond Count: 14
Exact Mass: 270.255880323
Monoisotopic Mass: 270.255880323
Topological Polar Surface Area: 26.3 Ų
Heavy Atom Count: 19
Complexity: 199
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes

Specifications of Isopropyl Myristate:
Color according to color reference solution Ph.Eur.: colorless liquid
Assay (GC, area%): ≥ 98.0 % (a/a)
Density (d 20 °C/ 4 °C): 0.853 - 0.854
Identity (IR): passes test

Acidity: 0.5mg KOH/g max.
Density: 0.8500g/mL
Boiling Point: 167.0°C (9.0 mmHg)
Flash Point: >110°C
Assay Percent Range: 95% min. (GC)
Infrared Spectrum: Authentic
Linear Formula: CH3(CH2)12COOCH(CH3)2
Packaging: Glass bottle
Merck Index: 15, 5261
Refractive Index: 1.4340 to 1.4360
Quantity: 25 g
Specific Gravity: 0.85
Formula Weight: 270.45
Percent Purity: 96%
Physical Form: Liquid
Chemical Name or Material: Isopropyl myristate, 96%

Acid Value (mg KOH/g): 0.5 Max
Saponification Value (mg KOH/g): 206-211
Color (APHA): 30 Max
Moisture Content (%): 0.1 Max
Ash Content (%): 0.1 Max
Peroxide Value (meq/Kg): 0.6 Max
Viscosity (mPa.s) 20℃: 5-6
Density (g/cm3) 20℃: 0.852-0.855
Refractive Index 20℃: 1.434-1.437

Names of Isopropyl Myristate:

Regulatory process names:
Isopropyl myristate
isopropyl myristate

CAS names:
Tetradecanoic acid, 1-methylethyl ester

IUPAC names:
1-Methylethyl Tetradecanoate
Alkyl alkanoate
bisomel
cadmium
IPM
ISOPROPYL MYRISTATE
Isopropyl Myristate
Isopropyl myristate
isopropyl myristate
ISOPROPYL MYRISTATE
Isopropyl Myristate
Isopropyl myristate
isopropyl myristate
Isopropyl Myristate (Tetradecanoic acid, 1-methylethyl ester) CAS 110-27-0
Isopropylmyristat
isopropylmyristate
Isopropylmyristate
Propan-2-yl tetradecanoate
propan-2-yl tetradecanoate
Tetradecanoic acid, 1-methylethyl ester
TETRADECANOIC ACID, 1-METHYLETHYL ESTER( MAIN COMPONENT )
Tetradecanoic acid, isopropyl ester
Tetradecanoic acid, isopropylester
Tetradecansäure-1-methylethylester

Preferred IUPAC name:
Propan-2-yl tetradecanoate

Trade names:
CHINT: FCE (i-Propyl)E C14
Crodamol IPM
DUB IPM
IPM-S
Isopropyl Palmitate
MMEster E1140
PALMESTER
Palmsurf IPM
Phase I REACH Kandidat
Q-Cos Oleo IPM
RADIA 7191
RADIA 7727
RADIA 7730
RADIA 7730K
RADIA 7730Q
WAGLINOL 6014
WAGLINOL 6014/95
WAGLINOL 6014/98
WAGLINOL 6014/N

Other names:
Tetradecanoic acid
1-methylethyl ester
Myristic acid isopropyl ester

Synonyms of Isopropyl Myristate:
ISOPROPYL MYRISTATE
110-27-0
Isopropyl tetradecanoate
Tetradecanoic acid, 1-methylethyl ester
Estergel
Bisomel
Isomyst
Promyr
Deltyl Extra
propan-2-yl tetradecanoate
Kesscomir
Tegester
Wickenol 101
Sinnoester MIP
Crodamol IPM
Plymoutm IPM
Stepan D-50
Starfol IPM
Unimate IPM
Kessco IPM
Emcol-IM
Myristic acid isopropyl ester
Emerest 2314
1-Methylethyl tetradecanoate
JA-FA IPM
FEMA No. 3556
Kessco isopropyl myristate
Crodamol I.P.M.
Tetradecanoic acid, isopropyl
Myristic acid, isopropyl ester
Isopropyl myristate [USAN]
Tetradecanoic acid, isopropyl ester
HSDB 626
NSC 406280
1-Tridecanecarboxylic acid, isopropyl ester
Estergel (TN)
methylethyl tetradecanoate
0RE8K4LNJS
iso-Propyl N-tetradecanoate
NSC-406280
CHEBI:90027
Tetradecanoic acid methyethyl ester
1405-98-7
NCGC00164071-01
Deltylextra
WE(2:0(1Me)/14:0)
Isopropyl myristate, 98%
Caswell No. 511E
CAS-110-27-0
EINECS 203-751-4
UNII-0RE8K4LNJS
MFCD00008982
EPA Pesticide Chemical Code 000207
Isopropyl tetradecanoic acid
BRN 1781127
Tegosoft M
Isopropyl myristate [USAN:NF]
Liponate IPM
Crodamol 1PM
isopropyl-myristate
Lexol IPM
Isopropyltetradecanoate
myristic acid isopropyl
Radia 7190
Isopropyl myristate (NF)
EC 203-751-4
SCHEMBL2442
Myristic acid-isopropyl ester
Isopropyl myristate, >=98%
CHEMBL207602
IPM 90
DTXSID0026838
ISOPROPYL MYRISTATE [II]
ISOPROPYL MYRISTATE [MI]
WLN: 13VOY1&1
FEMA 3556
tetradecanoic acid isopropyl ester
ISOPROPYL MYRISTATE [FHFI]
ISOPROPYL MYRISTATE [HSDB]
ISOPROPYL MYRISTATE [INCI]
ISOPROPYL MYRISTATE [VANDF]
ISOPROPYL MYRISTATE [MART.]
ZINC8214588
Isopropyl myristate, >=90% (GC)
Tox21_112080
Tox21_202065
Tox21_303171
ISOPROPYL MYRISTATE [USP-RS]
ISOPROPYL MYRISTATE [WHO-DD]
LMFA07010677
NSC406280
s2428
AKOS015902296
Tox21_112080_1
DB13966
NCGC00164071-02
NCGC00164071-03
NCGC00256937-01
NCGC00259614-01
ISOPROPYL MYRISTATE [EP MONOGRAPH]
LS-14615
DB-040910
HY-124190
CS-0085813
FT-0629053
M0481
MYRISTIC ACID, ISOPROPYL ALCOHOL ESTER
D02296
F71211
TETRADECONOIC ACID, 1-METHYLETHYL ESTER
EN300-25299830
Q416222
SR-01000944751
Isopropyl myristate, Vetec(TM) reagent grade, 98%
Q-201418
SR-01000944751-1
Isopropyl myristate, United States Pharmacopeia (USP) Reference Standard
TETRADECANOIC ACID,ISOPROPYL ESTER (MYRISTATE,ISOPROPYL ESTER)
Isopropyl myristate, Pharmaceutical Secondary Standard; Certified Reference Material
Lexate® TA
Lexol® 3975
Lexol® IPM
Lexol® IPM-NF MB
PALMESTER 1512 Isopropyl Myristate
PALMESTER 1514 Isopropyl Myristate
PARYOL EMOLL
PARYOL IPM
AE Ester IPM
Polymol® IPM
Dermol IPM
Wickenol 101
BergaCare EM-14
BergaCare EM-14 /MB
MIRITOL™ PM
CremerCOOR® IPM
Isopropyl Myristate 98%
MASSOCARE IPM
MASSOCARE SWAN
Crodarom® Carrot O (D)
Estol 1514 (D)
Spectraveil™ IPM (D)
Carrot Oil Extra
Crodamol™ CAP
DomusCare® IPM
Bentone Gel® IPM V
ERCAREL IPM V
TEGOSOFT® Liquid M
TEGOSOFT® M
Georges Walther ISOPROPYL MYRISTATE
Unipherol U-14
GranLux® IM1-40
CoVera™ IPM
HallStar® IPM
Dapracare® IPM
Aloe Vera Oil Extract IPM base
Jeelux® DMIPM
Jeelux® VHIPP
Exceparl® HO (D)
Dp-VitAHP2k (D)
IPM55S4 (D)
GCB50YSG
0RE8K4LNJS
110-27-0 [RN]
13VOY1&1 [WLN]
1-Methylethyl tetradecanoate
203-751-4 [EINECS]
IPM
IPM 100
IPM-EX
IPM-R
Isopropyl myristate [ACD/IUPAC Name] [USAN]
isopropyl tetradecanoate
Isopropylmyristat [German] [ACD/IUPAC Name]
MFCD00008982 [MDL number]
Myristate d'isopropyle [French] [ACD/IUPAC Name]
myristic acid isopropyl ester
Myristic acid, isopropyl ester
Propan-2-yl tetradecanoate
Tetradecanoic acid 1-methylethyl ester
Tetradecanoic acid isopropyl ester
Tetradecanoic acid, 1-methylethyl ester [ACD/Index Name]
Tetradecanoic acid, isopropyl ester
XB8600000
1-Tridecanecarboxylic acid, isopropyl ester
4-02-00-01132 (Beilstein Handbook Reference) [Beilstein]
Bisomel
Crodamol 1PM
Crodamol IPM
DELTYL EXTRA
Deltylextra
EINECS 203-751-4
Emcol-IM
Emerest 2314
Estergel [Trade name]
Estergel (TN)
FEMA 3556
IPM 90
Isomyst
Isopropyl myristate (NF)
iso-Propyl N-tetradecanoate
Isopropyl tetradecanoic acid
Isopropylmyristate
Isopropylmyristate, Tetradecanoic acid isopropyl ester, Myristic acid isopropyl ester, Sterile IPM
Ja-fa IPM
Jsp000796
Kessco IPM
Kessco isopropyl myristate
Kesscomir
Lexol IPM
Liponate IPM
Methylethyl tetradecanoate
Myristic acid-isopropyl ester
NCGC00164071-01
Promyr
Radia 7190
Sinnoester MIP
Starfol IPM
Stepan D-50
Sterile Isopropyl Myristate (IPM)
Tegester
Tegosoft M
Tetradecanoic acid isopropyl ester, Myristic acid isopropyl ester
Tetradecanoic acid methyethyl ester
Tetradecanoic acid, isopropyl
UNII:0RE8K4LNJS
UNII-0RE8K4LNJS
Unimate IPM
WE(2:0(1Me)/14:0)
Wickenol 101
WLN: 13VOY1&1