ISOAMYL BUTYRATE, N° CAS : 106-27-4, Nom INCI : ISOAMYL BUTYRATE. Nom chimique : 3-Methylbutyl Butanoate. N° EINECS/ELINCS : 203-380-8. Ses fonctions (INCI). Agent parfumant : Utilisé pour le parfum et les matières premières aromatiques

ISOAMYL CINNAMATE, N° CAS : 7779-65-9. Nom INCI : ISOAMYL CINNAMATE, Nom chimique : 2-Propenoic Acid, 3-Phenyl-, 3-Methylbutyl Ester. N° EINECS/ELINCS : 231-931-2. Ses fonctions (INCI). Agent masquant : Réduit ou inhibe l'odeur ou le goût de base du produit

ISOAMYL LAURATE, N° CAS : 6309-51-9, Nom INCI : ISOAMYL LAURATE. Nom chimique : Isopentyl laurate. N° EINECS/ELINCS : 228-626-1. Classification : Huile estérifiée. Emollient : Adoucit et assouplit la peau. Agent d'entretien de la peau : Maintient la peau en bon état

Isoamyl Cocoate. ISOAMYL COCOATE is classified as : Emollient; Skin conditioning. Chem/IUPAC Name: Isoamyl Cocoate is the ester of isoamyl alcohol and Coconut Acid. It conforms to the formula: (structure)where RCO- represents the coconut acid radical.A natural emollient ester derived from sugar beets and coconut oil. It's a very light liquid that absorbs quickly into the skin and has a non-oily skin feel. Item Number:170595CAS Number:6309-51-9Mfr: APPEARANCE: COLORLESS TO YELLOWISH LIQUID WITH SLIGHT SPECIFIC ODOR DESCRIPTION: Is a very light emollient that is completely based on natural raw materials. It has a low viscosity, low oiliness and absorbs easily. It is produced by enzymatic catalyis.

ISOAMYL P-METHOXYCINNAMATE, N° CAS : 71617-10-2. Origine(s) : Synthétique. Nom INCI : ISOAMYL P-METHOXYCINNAMATE. Nom chimique : Isopentyl p-methoxycinnamate. N° EINECS/ELINCS : 275-702-5. Ses fonctions (INCI) : Absorbant UV : Protège le produit cosmétique contre les effets de la lumière UV. Filtre UV : Permet de filtrer certains rayons UV afin de protéger la peau ou les cheveux des effets nocifs de ces rayons.

Isoamyl phenylacetate, also known as isopentyl phenylacetate or isoamyl phenyl acetate, is a chemical compound with the molecular formula C12H16O2.
Isoamyl phenylacetate is one of the volatile compounds found in apple pomace.
Isoamyl phenylacetate is often used in the fragrance and flavor industry due to its pleasant, fruity, and sweet aroma.

CAS Number: 102-19-2
Molecular Formula: C13H18O2
Molecular Weight: 206.28
EINECS Number: 203-012-6

Isoamyl phenylacetate, 102-19-2, Isopentyl phenylacetate, Isopentyl 2-phenylacetate, Benzeneacetic acid, 3-methylbutyl ester, 3-Methylbutyl phenylacetate, 3-methylbutyl 2-phenylacetate, Phenylacetic acid isoamyl ester, Phenylacetic acid, isopentyl ester, Isopentylphenylacetate, Isoamyl alpha-toluate, ACETIC ACID, PHENYL-, ISOPENTYL ESTER, 3-Methylbutyl benzeneacetate, FEMA No. 2081, NSC 60582, Isopentyl alcohol, phenylacetate, E5RHQ50DDC, NSC-60582, Phenylacetic acid, 3-methylbutyl ester, isoamyl phenyl acetate, EINECS 203-012-6, UNII-E5RHQ50DDC, BRN 1951778, AI3-36555, iso-Amyl phenylacetate, SCHEMBL996081, WLN: 1Y12OV1R, DTXSID2044501, FEMA 2081, CHEBI:191542, QWBQBUWZZBUFHN-UHFFFAOYSA-N, NSC60582, ISOAMYL PHENYLACETATE [FHFI], ISOAMYL PHENYL ACETATE [FCC], MFCD00026517, phenylacetic acid 3-methylbutyl ester, AKOS015890643, AS-75676, FT-0653077, P0123, D91902, W-108882, Q27276901, InChI=1/C13H18O2/c1-11(2)8-9-15-13(14)10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H.

Isoamyl phenylacetate has a sweet, pleasant odor reminiscent of cocoa with a slight birch-tar undertone.
May be prepared by esterification of phenylacetic acid with isoamyl alcohol in the presence of concentrated sulfuric acid; by heating benzyl nitrile and isoamyl alcohol in the presence of excess concentrated H2S04.
Isoamyl phenylacetate provides a fruity, banana-like scent with floral undertones.

Isoamyl phenylacetate belongs to the ester group of compounds and is derived from the reaction between isoamyl alcohol (also known as isopentyl alcohol) and phenylacetic acid.
Isoamyl phenylacetate, a phenethyl alcohol derivative, is commonly used as a flavor additive in tobacco.
Isoamyl phenylacetate is one of the volatile compounds found in apple pomace.

Isoamyl phenylacetate belongs to the class of organic compounds known as benzene and substituted derivatives.
These are aromatic compounds containing one monocyclic ring system consisting of benzene.
Based on a literature review very few articles have been published on Isoamyl phenylacetate.

The structure of Isoamyl phenylacetate consists of an isoamyl group (an isomer of amyl group) and a phenylacetate group.
The isoamyl group is a five-carbon chain with a branching structure, and the phenylacetate group consists of a phenyl ring (an aromatic ring) attached to an acetate moiety.
Isoamyl phenylacetate has a sweet, pleasant odor reminiscent of cocoa with a slight birch-tar undertone.

May be prepared by esterification of phenylacetic acid with isoamyl alcohol in the presence of concentrated sulfuric acid; by heating benzyl nitrile and isoamyl alcohol in the presence of excess concentrated H2S04.
Isoamyl phenylacetate, a phenethyl alcohol derivative, is commonly used as a flavor additive in tobacco.

As a result, isoamyl phenylacetate is utilized in the formulation of perfumes, colognes, and various scented products.
Additionally, Isoamyl phenylacetate may be employed as a flavoring agent in the food industry, contributing to the aroma of certain food products.
Isoamyl phenylacetate has a sweet, pleasant odor reminiscent of cocoa with a slight birch-tar undertone

Isoamyl phenylacetate belongs to the class of organic compounds known as benzene and substituted derivatives.
These are aromatic compounds containing one monocyclic ring system consisting of benzene.
Isoamyl phenylacetate is a sweet, animal, and balsam tasting compound. 3-Methylbutyl phenylacetate is found, on average, in the highest concentration within peppermints (Mentha X piperita).

This could make Isoamyl phenylacetate a potential biomarker for the consumption of these foods.
Based on a literature review very few articles have been published on 3-Methylbutyl phenylacetate.
Isoamyl phenylacetate has a sweet, pleasant odor reminiscent of cocoa with a slight birch-tar undertone

Isoamyl phenylacetate is a chemical compound commonly used in the fragrance and flavor industry.
Isoamyl phenylacetate has a sweet, fruity, and floral aroma that resembles ripe bananas or pears.
Isoamyl phenylacetate is often used as an ingredient in perfumes, soaps, lotions, and other personal care products.

Isoamyl phenylacetate can also be utilized as a food additive to enhance the flavor of various food and beverage products.
Safety precautions should be taken when handling this compound, including the use of gloves and eye protection.
Isoamyl phenylacetate should be stored in a cool, well-ventilated area away from sources of ignition or heat

Isoamyl phenylacetate is not directly found in large quantities in natural sources, some related compounds with similar aromatic characteristics are present in certain fruits.
These compounds contribute to the characteristic aroma of fruits and are often used as inspiration in the creation of synthetic fragrances.
The isoamyl group, also known as isopentyl group, is a branched alkyl group containing five carbon atoms.

The branching structure of this group contributes to the distinctive properties of isoamyl phenylacetate.
Isoamyl phenylacetate can be found in various cosmetic and personal care products, including lotions, creams, and hair care items, to add a pleasant and fruity scent to the products.
Perfumers often use Isoamyl phenylacetate in combination with other aroma compounds to create unique and complex fragrance profiles.

Isoamyl phenylacetate's fruity and floral notes make it a versatile ingredient in fragrance blends.
Fragrances, including those containing Isoamyl phenylacetate, can have a psychological impact on mood.
Fruity and floral scents are often associated with feelings of freshness and positivity, contributing to the overall sensory experience.

Isoamyl phenylacetate is commonly used in a variety of consumer products, including air fresheners, fabric softeners, and scented candles, to enhance the aroma and create a pleasant environment.
The use of Isoamyl phenylacetate in consumer products is subject to regulations and guidelines established by regulatory bodies such as the International Fragrance Association (IFRA) to ensure safety and proper usage levels.
Trade and Commercial Availability: Isoamyl phenylacetate is commercially available from suppliers specializing in fragrance and flavor ingredients.

Isoamyl phenylacetate is traded as a raw material for use in various industries.
Formulators need to consider the compatibility of Isoamyl phenylacetate with other ingredients in their formulations to achieve the desired scent and product stability.
By esterification of phenylacetic acid with isoamyl alcohol in the presence of concentrated sulfuric acid; by heating benzyl nitrile and isoamyl alcohol in the presence of excess concentrated H2SO4

Isoamyl phenylacetate belongs to the class of organic compounds known as benzene and substituted derivatives.
These are aromatic compounds containing one monocyclic ring system consisting of benzene.
Isoamyl phenylacetate is a sweet, animal, and balsam tasting compound.

Isoamyl phenylacetate is found, on average, in the highest concentration within peppermints (Mentha X piperita).
This could make 3-methylbutyl phenylacetate a potential biomarker for the consumption of these foods.
Based on a literature review very few articles have been published on 3-Methylbutyl phenylacetate.

Isoamyl phenylacetate is a colorless to pale yellow, water insoluble liquid with a sweet, cocoa balsam, chocolate aroma.
Isoamyl phenylacetate may be used as a flavoring agent which offers a taste of rosy, honey with phenyl chocolate nuances and dried fruit notes.
Isoamyl phenylacetate is a synthetic product with detergent compositions.

Isoamyl phenylacetate can be used as a polymerization initiator in the production of cellulose derivatives that are soluble in organic solvents.
Isoamyl phenylacetate is an acid complex with the chemical formula C11H14O2, which has a dry weight of 150.6 grams per mole and a molecular weight of 198.27 g/mol.
Isoamyl phenylacetate has been shown to have acidic properties at pH values below 7 and is classified as an acid catalyst for reactions involving diploid compounds.

Structural formulas for this compound have been determined by X-ray crystallography and NMR spectroscopy, and it has been observed to be stable under constant temperature conditions.
Isoamyl phenylacetate is a colorless to pale yellow liquid at room temperature.
Isoamyl phenylacetate has a fairly long shelf life and occurs in nature, but the synthetic version is used for use as a fragrance.

Isoamyl phenylacetate is known for its aromatic and fruity fragrance, often described as having a sweet, floral, and fruity character.
The fruity notes are reminiscent of bananas.
Due to its pleasant scent, Isoamyl phenylacetate is commonly used in the perfume and fragrance industry.

Isoamyl phenylacetate is often included in floral and fruity fragrance compositions, contributing to the overall olfactory profile of the final product.
In the food industry, isoamyl phenylacetate may be employed as a flavoring agent to impart a fruity and sweet taste.
However, Isoamyl phenylacetate is use in the food industry is typically limited compared to its applications in the fragrance sector.

Isoamyl phenylacetate can be synthesized in the laboratory for commercial purposes, some esters with similar aromatic characteristics are found naturally in certain fruits.
This contributes to its use in creating natural or nature-inspired fragrances.
Isoamyl phenylacetate belongs to the ester group of organic compounds.

Esters are commonly known for their pleasant odors and flavors and are often found in essential oils and fruit extracts.
Isoamyl phenylacetate is typically synthesized through the reaction of isoamyl alcohol (isopentyl alcohol) with phenylacetic acid in the presence of an acid catalyst.
This esterification process results in the formation of isoamyl phenylacetate.

Isoamyl phenylacetate is generally insoluble in water but soluble in organic solvents.
This characteristic influences its application in various formulations where solubility is a consideration.
The stability of Isoamyl phenylacetate can be influenced by factors such as exposure to light, heat, and air.

Proper storage conditions are essential to maintain the compound's quality and prevent degradation.
Isoamyl phenylacetate's stability in formulations can be influenced by factors such as pH, temperature, and the presence of other ingredients.
Formulators need to consider these factors to ensure the Isoamyl phenylacetate remains stable throughout the product's shelf life.

The sensory threshold of isoamyl phenylacetate—the concentration at which it can be detected by the human nose—can vary.
Perfumers and formulators consider these thresholds to determine the optimal concentration for a given application.
In addition to its use as a fragrance compound, Isoamyl phenylacetate may be employed in the food industry as a flavor enhancer.

Isoamyl phenylacetate can contribute to the overall flavor profile of certain food products.
Fragrance compounds like isoamyl phenylacetate not only contribute to the actual scent of a product but also influence the overall perception of the product.
The scent can evoke specific emotions or associations, contributing to the overall consumer experience.

Isoamyl phenylacetate might be used in niche or artisanal perfumery, where perfumers often experiment with unique combinations of ingredients to create distinctive and unconventional scents.
While isoamyl phenylacetate is often synthesized in the laboratory, natural extracts containing related compounds with similar aromas can be obtained from certain plants.
However, Isoamyl phenylacetate itself is typically more cost-effective to produce synthetically.

Isoamyl phenylacetate is commonly used as a reference standard in laboratories and educational settings.
Isoamyl phenylacetate is well-defined chemical structure makes it a useful compound for analytical and research purposes.

Isoamyl phenylacetate is generally stable and safe under normal handling conditions.
However, as with any chemical, proper precautions should be taken during transport, storage, and handling to prevent spills and ensure workplace safety.
Isoamyl phenylacetate is traded globally as a raw material for fragrance and flavor applications.

Boiling point: 268 °C(lit.)
Density: 0.98
vapor pressure: 0.907Pa at 25℃
refractive index: n20/D 1.485(lit.)
FEMA: 2081 | ISOAMYL PHENYLACETATE
Flash point: >230 °F
form: clear liquid
color: Colorless to Almost colorless
Odor: at 10.00 % in dipropylene glycol. sweet honey cocoa balsam chocolate castoreum animal
Odor Type: chocolate
Water Solubility: 63.049mg/L at 25℃
JECFA Number: 1014
LogP: 4.08 at 25℃

Isoamyl phenylacetate is commonly synthesized in the laboratory, it can also be found in trace amounts in certain natural sources.
Some plants may contain compounds with similar aromas, and these natural extracts might be used in the fragrance and flavor industry.
Formulating with isoamyl phenylacetate may present challenges, especially in achieving the desired balance of fragrance notes and ensuring compatibility with other ingredients.

Perfumers and formulators often experiment to find optimal combinations.
The choice of packaging materials can influence the stability of isoamyl phenylacetate-containing products.
Perfume bottles, cosmetic containers, or packaging for scented products need to be selected carefully to prevent interactions that could affect the compound's properties.

Isoamyl phenylacetate may exhibit synergistic effects when combined with other esters or fragrance compounds.
Perfumers may leverage these synergies to create more complex and harmonious scent profiles.
In some applications, microencapsulation techniques might be employed to encapsulate isoamyl phenylacetate.

This approach can provide controlled release of the fragrance over time, enhancing the longevity of scented products.
Over time, the scent of products containing isoamyl phenylacetate may evolve due to factors such as oxidation or chemical interactions.
Understanding the aging process and monitoring the shelf life of products is essential for maintaining consistent quality.

Fragrance preferences can vary across cultures and regions.
Companies may adapt formulations containing isoamyl phenylacetate to align with local preferences, taking into account cultural nuances and market demands.
Advances in fragrance delivery systems, encapsulation technologies, or sustainable extraction methods can impact how isoamyl phenylacetate is utilized in formulations.

Staying abreast of emerging technologies is crucial for innovation in the industry.
Ongoing research and development may lead to the discovery of new aroma compounds or more sustainable alternatives.
Companies may explore substitutions for isoamyl phenylacetate based on consumer trends or regulatory considerations.

The fragrance and flavor industry often involves collaboration between different entities, including perfumers, formulators, suppliers, and manufacturers.
Collaboration fosters creativity and innovation in creating new products and scents.
Isoamyl phenylacetate has a strong spicy scent reminiscent of cocoa.

In use, the scent is a bit richer: beeswax, honey, amber.
Isoamyl phenylacetate is used in chocolate accords, just adding (enough) vanillin or ethyl vanillin is enough to make a nice chocolate scent.
Also very suitable in sweet animal compositions such as beeswax, honey and civet.

The French perfumer Jean Claude Ellena recognizes chamomile in Isoamyl phenylacetate and indeed there is also a characteristic bitter animal note in it.
Isoamyl phenylacetate is primarily a heart to base note in perfumes and is stable in most products, including soaps and more acidic products.
Keep cool, dry, dark and out of reach of children.

Isoamyl phenylacetate is typically a racemic mixture, meaning it contains equal amounts of both enantiomers (mirror-image isomers).
In certain applications, the specific enantiomeric composition may be relevant, especially in industries like pharmaceuticals where stereochemistry can impact biological activity.
The biodegradability of isoamyl phenylacetate is an important consideration, especially in industries aiming for environmentally friendly practices.

Assessments of Isoamyl phenylacetate's fate in the environment help ensure its impact is minimal.
Researchers may explore alternative synthesis routes for isoamyl phenylacetate to improve efficiency, reduce costs, or address environmental concerns.
Green chemistry principles often guide the development of more sustainable synthesis methods.

Isoamyl phenylacetate, like many fragrance compounds, can exhibit variation in scent due to factors such as temperature, humidity, and the specific formulation it is a part of.
Perfumers and formulators account for these variations to maintain consistent product quality.
In some formulations, isoamyl phenylacetate may be combined with natural extracts or essential oils to create a more complex and nuanced fragrance.

This blending allows for the creation of unique and distinctive scents.
Isoamyl phenylacetate can be used in the production of scented candles.
Isoamyl phenylacetate adds a fruity and floral note to the candle's fragrance, enhancing the overall olfactory experience when the candle is burned.

Companies involved in the fragrance and flavor industry may explore patent applications related to the synthesis, formulations, or specific applications of isoamyl phenylacetate to protect their innovations.
As with any fragrance compound, some individuals may be more sensitive or allergic to isoamyl phenylacetate.
Companies consider potential consumer sensitivities and may conduct patch tests to ensure the safety of their products.

Isoamyl phenylacetate is generally stable under normal conditions.
However, understanding its reactivity with other chemicals in specific formulations is crucial for ensuring product stability and safety.
Trends in the fragrance and flavor industry, such as the demand for natural ingredients, transparency in labeling, and the rise of sustainable practices, can influence the use and marketability of compounds like isoamyl phenylacetate.

Fragrance, including that of isoamyl phenylacetate, can evoke memories and influence perceptions.
The choice of this compound in formulations may be guided by its ability to create positive associations or elicit specific emotions in consumers.
Perfume houses and cosmetic companies often invest in the development of custom fragrances to distinguish their products.

Isoamyl phenylacetate, with its distinctive fruity and floral notes, may be a key component in creating unique and signature scents.
Companies may conduct consumer testing and focus groups to evaluate the appeal of products containing isoamyl phenylacetate.
The rise of online shopping and e-commerce has influenced how consumers experience fragrances.

Uses:
Isoamyl phenylacetate is widely used in perfumery to impart a pleasant and distinctive aroma to various fragrance formulations.
Isoamyl phenylacetate contributes fruity, floral, and sweet notes, making it suitable for a variety of perfumes and colognes.
Isoamyl phenylacetate is utilized in the formulation of cosmetics and personal care products, including lotions, creams, shampoos, and soaps.

Isoamyl phenylacetate adds a pleasant fragrance to these products, enhancing the overall sensory experience for consumers.
Isoamyl phenylacetate is incorporated into scented candles and air fresheners, contributing to the creation of a pleasant ambiance in homes and commercial spaces.
In the food industry, isoamyl phenylacetate may be used as a flavoring agent to impart a fruity and sweet taste.

However, Isoamyl phenylacetate is use in food is generally limited compared to its applications in the fragrance sector.
Due to its pleasing aroma, isoamyl phenylacetate may find use in aromatherapy products such as essential oils, diffusers, and massage oils, contributing to relaxation and mood enhancement.
Isoamyl phenylacetate is employed in various household products, including cleaning agents, fabric softeners, and laundry detergents, to provide a pleasant scent to these products.

Isoamyl phenylacetate may be used in certain industrial applications where a specific fragrance is desired, such as in the production of adhesives, sealants, or other specialty chemicals.
Isoamyl phenylacetate may be used in the textile industry to impart a pleasant fragrance to fabrics and textiles.
Scented fabrics are sometimes employed in the production of clothing, linens, or home textiles.

Isoamyl phenylacetate is a common ingredient in air care products such as room sprays, reed diffusers, and plug-in air fresheners.
Isoamyl phenylacetate is fruity and floral notes contribute to a pleasing and long-lasting fragrance in indoor spaces.
Isoamyl phenylacetate's characteristic floral and fruity notes make it suitable for the creation of floral or fruity fragrances.

Isoamyl phenylacetate is often used as a key component in perfumes and scented products where these fragrance profiles are desired.
Perfumers often use isoamyl phenylacetate as part of custom fragrance blends, experimenting with different combinations to create unique and signature scents for specific brands or products.
Isoamyl phenylacetate may be included in pet care products such as pet shampoos, grooming sprays, or pet deodorizers to provide a pleasant scent for pets.

Isoamyl phenylacetate is sometimes featured in niche or artisanal fragrance products, where a specific and unique scent profile is desired to cater to niche markets or specific consumer preferences.
Isoamyl phenylacetate can be used in the production of scented stationery, notebooks, or paper-based products, enhancing the olfactory experience for users.
Fragrances, including isoamyl phenylacetate, might be used in agricultural or horticultural applications to enhance the scent of certain products or to mask odors associated with fertilizers or pesticides.

Isoamyl phenylacetate is commonly used in laboratories and educational settings as a reference standard in the study of fragrance compounds and their properties.
Isoamyl phenylacetate may be featured in novelty products, seasonal items, or limited-edition releases where a specific fragrance is desired to match a theme or occasion.
Isoamyl phenylacetate might find limited application in the culinary field where a specific fruity or floral note is desired.

Isoamyl phenylacetate could be used in trace amounts in certain food and beverage products.
Isoamyl phenylacetate may be included in scented hand sanitizers or disinfectants, contributing to a pleasant fragrance and potentially enhancing the user experience.
Isoamyl phenylacetate might be used in the production of scented toys, playdough, or other children's products to add an appealing fragrance.

Given its pleasant and versatile aroma, Isoamyl phenylacetate can be featured in holiday-themed or seasonal fragrance formulations, contributing to the festive ambiance of products.
Fragrance compounds, including isoamyl phenylacetate, may be incorporated into scented jewelry, such as diffuser necklaces or bracelets, providing a personal and portable aromatic experience.
Fragrance compounds are sometimes added to packaging materials, such as scented cardboard or wrapping paper, to enhance the unboxing experience and add an olfactory element to products.

In the manufacturing of artificial flowers or decorative items, isoamyl phenylacetate may be added to simulate a natural floral scent, enhancing the realism of the artificial products.
Fragrance compounds can be used in marketing materials, such as scented brochures, promotional items, or product samples, to create a memorable and multisensory brand experience.
Isoamyl phenylacetate might be used in retail environments for aroma marketing, enhancing the overall shopping experience and influencing consumer behavior through strategically chosen scents.

Isoamyl phenylacetate could be incorporated into products designed to promote relaxation and sleep, such as scented pillows, sleep masks, or aromatherapy blends for bedtime.
In the entertainment industry, including virtual reality and gaming, fragrances, including those with isoamyl phenylacetate, can be introduced to enhance immersive experiences by adding olfactory elements.
Isoamyl phenylacetate could be infused into sleepwear fabrics or bedding materials, providing a subtle and long-lasting fragrance to enhance the sleeping environment.

Isoamyl phenylacetate might be incorporated into hair care products such as shampoos, conditioners, and styling products to impart a pleasant fragrance to the hair.
In the realm of temporary tattoos or body art, isoamyl phenylacetate could be added to create scented designs, offering a unique sensory experience.
Fragrance compounds, including isoamyl phenylacetate, may find use in educational materials such as scented books, flashcards, or learning aids to engage multiple senses in the learning process.

Isoamyl phenylacetate could be incorporated into pet care items like pet beds, toys, or grooming products to provide a pleasant scent for pets and their owners.
Isoamyl phenylacetate may be used in scented wellness products, including spa items such as scented massage oils, bath salts, and relaxation aids.
Isoamyl phenylacetate might be applied to footwear, insoles, or shoe packaging to add a subtle fragrance to shoes.

Isoamyl phenylacetates can be integrated into automobile accessories such as air fresheners, seat covers, or car mats to create a pleasant interior fragrance.
Isoamyl phenylacetate could be incorporated into fitness-related products, such as scented yoga mats, workout accessories, or sportswear.
In the tech industry, fragrance Isoamyl phenylacetate might be incorporated into devices like smartphones, tablets, or laptops to introduce a subtle and pleasing aroma during use.

Isoamyl phenylacetate could be utilized in scented craft supplies or do-it-yourself (DIY) materials to add fragrance to handmade items.
Fragrance compounds might be used in gardening products such as scented plant markers, potting soil, or decorative items for outdoor spaces.
In event planning, fragrance compounds like isoamyl phenylacetate might be incorporated into merchandise such as scented event tickets, promotional items, or gift bags.

Safety Profile:
Inhalation of vapors or mists may cause respiratory irritation.
Isoamyl phenylacetate's advisable to use proper ventilation or personal protective equipment, such as a mask, in areas where isoamyl phenylacetate is handled in high concentrations.
Prolonged or repeated skin contact may cause irritation.

Isoamyl phenylacetate's recommended to use protective gloves and, if necessary, protective clothing to prevent skin exposure.
In case of contact, wash the affected area with plenty of water.
Contact with the eyes may cause irritation.

In case of eye contact, Isoamyl phenylacetate's important to rinse the eyes thoroughly with water for at least 15 minutes and seek medical attention if irritation persists.
Isoamyl phenylacetate is not intended for ingestion, accidental ingestion may lead to irritation of the gastrointestinal tract.

If ingested, seek medical attention immediately and provide information about the ingested substance.
Isoamyl phenylacetate is typically not highly flammable.
However, as with any organic compound, it should be stored away from open flames and heat sources.

ISOAMYL SALICYLATE, N° CAS : 87-20-7, Nom INCI : ISOAMYL SALICYLATE, Nom chimique : Isopentyl 2-Hydroxybenzoate, N° EINECS/ELINCS : 201-730-4. Ses fonctions (INCI): Agent parfumant : Utilisé pour le parfum et les matières premières aromatiques

ISOBORNEOL, N° CAS : 124-76-5, Nom INCI : ISOBORNEOL Nom chimique : exo-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol N° EINECS/ELINCS : 204-712-4 Ses fonctions (INCI) Agent parfumant : Utilisé pour le parfum et les matières premières aromatiques

Isoascorbic acid is a stereoisomer of ascorbic acid (vitamin C) in the form on.
Isoascorbic acid is widely used as a preservative and color stabilizer for foods and beverages.
Isoascorbic acid is a vegetable-derived food additive produced from sucrose.

CAS Number: 89-65-6
EC Number: 201-928-0
Molecular Formula: C6H8O6
Molecular Weight: 176.13 g/mol

Isoascorbic acid is applied as an antioxidant in the food industry.
Isoascorbic acid (isoascorbic acid, D-araboascorbic acid) is a stereoisomer of ascorbic acid (vitamin C).

Isoascorbic acid is synthesized by a reaction between methyl 2-keto-D-gluconate and sodium methoxide.
Isoascorbic acid can also be synthesized from sucrose or by strains of Penicillium that have been selected for this feature.
Isoascorbic acid is denoted by E number E315, and is widely used as an antioxidant in processed foods.

Clinical trials have been conducted to investigate aspects of the nutritional value of Isoascorbic acid.
One such trial investigated the effects of Isoascorbic acid on vitamin C metabolism in young women.
No effect on vitamin C uptake or clearance from the body was found.

Since the U.S. Food and Drug Administration banned the use of sulfites as a preservative in foods intended to be eaten fresh (such as salad bar ingredients), the use of Isoascorbic acid as a food preservative has increased.
Isoascorbic acid is also used as a preservative in cured meats and frozen vegetables.

Isoascorbic acid (D-Isoascorbic acid), produced from sugars derived from different sources, such as beets, sugar cane, and corn, is a food additive used predominantly in meats, poultry, and soft drinks.
Isoascorbic acid is a stereoisomer of ascorbic acid.

Isoascorbic acid is widely used as a preservative and color stabilizer for foods and beverages.
As a vegetable-derived food additive, Isoascorbic acid can be considered natural.

Isoascorbic acid, formerly known as isoascorbic acid and D-araboascorbic acid, is a stereoisomer of ascorbic acid (vitamin C).
Isoascorbic acid is a vegetable-derived food additive produced from sucrose.

Isoascorbic acid is widely used as an antioxidant in processed foods.
The use of Isoascorbic acid as a food preservative has increased.
Isoascorbic acid is also used as a preservative in cured meats and frozen vegetables.

Isoascoribic acid, erythoribic acid is a natural product, vegetable derived food additive produced from sucrose.
Isoascorbic acid is an important antioxidant in the food industry, which can keep the color, natural flavor of foods and lengthen food storage without toxic and side effects.

Isoascorbic acid is used in cured meat processing, frozen fruits, frozen vegetables, jams, and in the beverage industry such as beer, grape wine, soft drink, fruit juice and fruit teas.
Isoascorbic acid's use has increased tremendously ever since the U.S. Food and Drug Administration banned the use of sulfites as a preservative in foods to be eaten fresh (ie: salad bar ingredients).

Isoascorbic acid is a stereoisomer of ascorbic acid (vitamin C) in the form on.
Isoascorbic acid is a widely used antioxidant.
Isoascorbic acid is mostly used as an antioxidant (industrial and food), especially in the brewing industry, and as a reducing agent for photography.

Isoascorbic acid a crystalline powder with a sugar like odor with dusts that have the tendency to cause mild irritation in eyes, skin, nose and throat.
Isoascorbic acid is used as a preservative in the food packaging.

The Isoascorbic acid market has been gaining significant traction from the food packaging industry owing to the ban over the use of sulfites as a preservative in canned and frozen foods resulting in rise in the market for Isoascorbic acid.
Isoascorbic acid is non-volatile and inflammable and is thus a popular product in the food preservation.

Apart from using a preservative Isoascorbic acid is also used as a color stabilizer in during food preservation.
Isoascorbic acid is also used in small quantities in pharmaceutical industry for preparation of various types of drugs.

Isoascorbic acid is common that sometimes consumers have questions whether Isoascorbic acid is bad for our health and what are the side effects in the food we eat.
However, Isoascorbic acid is generally considered safe and almost no reported health risks.
Maybe some people are allergic or sensitive to Isoascorbic acid.

Isoascorbic acid (syn: isoascorbic acid, D-araboascorbic acid) is a stereoisomer of ascorbic acid and has similar technological applications as a water-soluble antioxidant.
Isoascorbic acid was previously evaluated under the name isoascorbic acid by the sixth and seventeenth meetings of the Committee.

At the last evaluation an ADI of 0-5 mg/kg b.w. was allocated, based on a long-term study in rats, and a toxicological monograph was prepared.
The name Isoascorbic acid was changed to Isoascorbic acid in accordance with the "Guidelines for designating titles for specifications monographs" adopted at the thirty-third meeting of the Committee.

Isoascorbic acids safety used as a food additive has been approved by the U.S. Food and Drug Administration (FDA), European Food Safety Authority (EFSA), Joint FAO/WHO Expert Committee on Food Additives (JECFA), as well as other authorities.

Isoascorbic acid is a stereoisomer of ascorbic acid (vitamin C).
Isoascorbic acid is synthesized by a reaction between methyl 2-keto-D-gluconate and sodium methoxide.

Isoascorbic acid can also be synthesized from sucrose or by strains of Penicillium that have been selected for this feature.
Isoascorbic acid is denoted by E number E315, and is widely used as an antioxidant in processed foods.

Clinical trials have been conducted to investigate aspects of the nutritional value of Isoascorbic acid.
One such trial investigated the effects of Isoascorbic acid on vitamin C metabolism in young women; no effect on vitamin C uptake or clearance from the body was found.
A later study found that Isoascorbic acid is a potent enhancer of nonheme-iron absorption.

Since the U.S. Food and Drug Administration banned the use of sulfites as a preservative in foods intended to be eaten fresh (such as salad bar ingredients), the use of Isoascorbic acid as a food preservative has increased.

Isoascorbic acid is also used as a preservative in cured meats and frozen vegetables.
Isoascorbic acid was first synthesized in 1933 by the German chemists Kurt Maurer and Bruno Schiedt.

Applications of Isoascorbic acid:
Generally, Isoascorbic acid is widely used to stabilize color, reduce nitrate uses, and prevent oxidation in meat products, fruits and vegetables.
Meanwhile, Isoascorbic acid benefits our body through reducing nitrosamine formation which is generated by the intake of nitrate.

Pharmaceutical Applications of Isoascorbic acid:
Isoascorbic acid is a stereoisomer of L-ascorbic acid, and is used as an antioxidant in foods and oral pharmaceutical formulations.
Isoascorbic acid has approximately 5% of the vitamin C activity of L-ascorbic acid.

Functions and Applications of Isoascorbic acid:
Isoascorbic acid is produced in acidic condition by sodium erythorbate.
Isoascorbic acid has strong reducing action and has effects on reducing blood press, diuresis, generationg liver glycogen,excreting pigment,detoxifying the body.

Isoascorbic acid is non-toxic.
Isoascorbic acids other applications are familiar to sodium erythorbate.

Sodium erythorbateand Isoascorbic acid are generally recognized as the lastest A-class Green products internationally and have become the commodities in short supply both at home and abroad.

Isoascorbic acid is a potent enhancer of iron absorption, Isoascorbic acids lack of antiscorbutic activity limits Isoascorbic acid usefulness in iron-fortification programs.
Isoascorbic acid may play a major role in enhancing iron bioavailability from mixed diets that include foods preserved with Isoascorbic acid.

Uses of Isoascorbic acid:
Isoascorbic acid used as Antioxidant (industrial and food), especially in brewing industry, reducing agent in photography.
Isoascorbic acid is a food preservative that is a strong reducing agent (oxygen accepting) which functions similarly to antioxidants.

In the dry crystalline state Isoascorbic acid is nonreactive, but in water solutions Isoascorbic acid reacts readily with atmospheric oxygen and other oxidizing agents, making Isoascorbic acid valuable as an antioxidant.
During preparation, dissolving and mixing should incorporate a minimum amount of air, and storage should be at cool temperatures.

Isoascorbic acid has a solubility of 43 g/100 ml of water at 25°c.
One part is equivalent to one part ascorbic acid and equivalent to one part sodium erythorbate.

Isoascorbic acid is used to control oxidative color and flavor deterioration in fruits at 150–200 ppm.
Isoascorbic acid is used in meat curing to speed and control the nitrite curing reaction and prolong the color of cured meat at levels of 0.05%.

Generally, Isoascorbic acid is widely used to stabilize color, reduce nitrate uses, and prevent oxidation in meat products, fruits and vegetables.
And therefore maintain the color & flavor and extend their shelf life.

Meanwhile, Isoascorbic acid benefits our body through reducing nitrosamine formation which is generated by the intake of nitrate.
Isoascorbic acid is also used as a preservative in cured meats and frozen vegetables.

Isoascorbic acid is mostly used as an antioxidant (industrial and food), especially in the brewing industry, and as a reducing agent for photography.
Isoascorbic acid is widely used as an antioxidant in processed foods, cured meats and frozen vegetables.

Isoascorbic acid is able to replace nitrates in meat applications.
Isoascorbic acid is a food preservative that is a strong reducing agent (oxygen accepting) which functions similarly to antioxidants.

In the dry crystalline state Isoascorbic acid is nonreactive, but in water solutions Isoascorbic acid reacts readily with atmospheric oxygen and other oxidizing agents, making Isoascorbic acid valuable as an antioxidant.
During preparation, dissolving and mixing should incorporate a minimum amount of air, and storage should be at cool temperatures.

Isoascorbic acid has a solubility of 43 g/100 ml of water at 25°c. One part is equivalent to one part ascorbic acid and equivalent to one part sodium erythorbate.
Isoascorbic acid is used to control oxidative color and flavor deterioration in fruits at 150–200 ppm.

Isoascorbic acid is used in meat curing to speed and control the nitrite curing reaction and prolong the color of cured meat at levels of 0.05%.
Isoascorbic acid is a stereoisomer of L-ascorbic acid, and is used as an antioxidant in foods and oral pharmaceutical formulations.
Isoascorbic acid has approximately 5% of the vitamin C activity of L-ascorbic acid.

Food:
Isoascorbic acids main uses are in meat products, fruits & vegetables and also in soft drinks & beer.

Meat products:
Cured and preserved meat products takes an important part in the meat industry.

Provide a bright red color:
In order to achieve the purpose of preserving meat products and produce a bright red color, the traditional method is to add nitrate which can interact with amines in the human body to form a carcinogen nitrosamine, which is harmful to our health.

Reduce nitrosamines:
Isoascorbic acid can significantly reduce the production of nitrosamines if the combination uses of Isoascorbic acid with nitrite.
At the same time, Isoascorbic acid can stabilize the color of meat.

Isoascorbic acid was reported by Mintel GNDP that nearly 5,000 products out of nearly 1 million products sold in Europe contain Isoascorbic acid or sodium erythorbate in meat products or products contained meat as an ingredient (e.g. pizza, ready-to-eat meat meals, meat-based spread and filled pasta).

Isoascorbic acid is a stereoisomer of ascorbic acid.
Isoascorbic acid is widely used as a preservative and color stabilizer for foods and beverages.
As a vegetable-derived food additive, Isoascorbic acid can be considered natural.

Fruits and Vegetable Processing:
Fresh fruit and vegetable products can easily cause quality problems during the preservation, such as microbial growth, softening, weightlessness and browning due to cracks.

The traditional browning inhibitor is sulfur, but Isoascorbic acid can cause several health problems such as high blood pressure.
Isoascorbic acid or sodium erythorbate can be used to keep the freshness and stabilize the color of fruit and vegetables by soaking or spraying Isoascorbic acids solution on the surface.

Drink and Beer:
Isoascorbic acid and Isoascorbic acids sodium salt can be used as an antioxidant in beverages, beer and etc.

Isoascorbic acid can eliminate the discoloration, odor and turbidity, and improve the poor taste of beverages.
In beer, Isoascorbic acid can remove the stale odor, enhance flavor stability, and prolong Isoascorbic acid shelf life.

Formerly known as isoascorbic acid, Isoascorbic acid is a stereoisomer of ascorbic acid (vitamin C).
Isoascorbic acid is a vegetable derived food additive produced from sucrose.

Isoascorbic acid is widely used as an antioxidant in processed foods.
Isoascorbic acid is a water-soluble antioxidant, used mainly as an ingredient in soft drinks.
Isoascorbic acid has no known mutagenic or carcinogenic properties, and has not been shown to inhibit the uptake of any vitamins or minerals.

Cosmetics:
Per the “European Commission database for information on cosmetic substances and ingredients”, Isoascorbic acid functions as an antioxidant in cosmetic and personal care products.
Isoascorbic acid can be found in hair and nail products.

Usage Areas of Isoascorbic acid:
Antioxidants
Bacon
Sauage
Meats
Brewing
Soft Drink
Beverage Powder
Fruit Juice
Ice Cream, Fruit Sauces
Chewing Gum
Confections
Baking Food
Yogurt
Color Stabilizer Flavoring Agent
Preservative
Nutrient
Dietary Supplement
Cosmetics
Feed
Pharmaceutical

Authorised Uses of Isoascorbic acid:

The following foods may contain Isoascorbic acid:
Cured and preserved meat products
Frozen and deep-frozen fish with red skin

Preserved and semi-preserved fish products
Food Standards Australia New Zealand
Isoascorbic acid is an approved ingredient in Australia and New Zealand with the code number 315.

Isoascorbic acid is readily absorbed and metabolized.
Following an oral dose of 500 mg of Isoascorbic acid to human subjects the blood level curves for ascorbic acid and Isoascorbic acid showed a similar rise.
In five human subjects, an oral dose of 300 mg was shown to have no effect on urinary excretion of ascorbic acid.

Isoascorbic acid was found to have no antagonistic effect on the action of ascorbic acid.
Isoascorbic acid (E315 or Isoascorbic Acid) is a white to slight yellow crystal or powder.

Isoascorbic acid can darken on exposure to light.
Isoascorbic acid is soluble in water, alcohol, pyridine, oxygenated solvents and slightly soluble in glycerin.

Industry Uses:
Binder
Corrosion inhibitors and anti-scaling agents
Not Known or Reasonably Ascertainable
Other (specify)
Paint additives and coating additives not described by other categories
Pigment
Process regulators
Reducing agent
Surface active agents

Consumer Uses:
Binder
Catalyst
Corrosion inhibitors and anti-scaling agents
Not Known or Reasonably Ascertainable
Other (specify)
Paint additives and coating additives not described by other categories
Process regulators
Reducing agent
Surface active agents

Possible Side Effects of Isoascorbic acid:
Although Isoascorbic acid generally regarded as a very safe and effective supplement, there can be some minor side effects.

The side effects may:
Possible short-term side effects
Headaches
Dizziness
Fatigue
Body flushing
Hemolysis

Chemical Properties of Isoascorbic acid:
Isoascorbic acid occurs as a white or slightly yellow-colored crystals or powder.
Isoascorbic acid gradually darkens in color upon exposure to light.

Manufacturing of Isoascorbic acid:
Isoascorbic acid can be produced by a reaction between methyl 2-keto-D-gluconate and sulphuric acid.

Generally, the manufacturing process of Isoascorbic acid has 5 steps:
Producing calcium 2-keto-D-gluconate: food-grade starch hydrolysate fermentation by Pseudomonas fluorescens with calcium carbonate.
Acidify the above fermentation broth to obtain 2-keto-D-gluconic acid (2-KG).
Esterification 2-KG with methanol under acid conditions to yield methyl 2-keto-D-gluconate.

The synthesis of sodium erythorbate: heating the above suspension with sodium bicarbonate or sodium carbonate.
The reaction between sodium erythorbate and sulphuric acid.

Manufacturing Methods of Isoascorbic acid:
Isoascorbic acid is synthesized by the reaction between methyl 2-keto-D-gluconate and sodium methoxide.
Isoascorbic acid can also be synthesized from sucrose and produced from Penicillium spp.

Isoascorbic acid can also be prepared by reacting 2-keto-D-gluconate with sodium methoxide, synthesized from sucrose, or naturally produced by Penicililum species. Sodium erythorbate is prepared from D-glucose by a combination of biosynthesis and chemical synthesis via the intermediate 2-keto-D-gluconic acid.

Isoascorbic acid is produced by the fermentation of D-glucose to 2-keto-D-gluconic acid by Pseudomonas fluorescens bacteria.
The fermentation product is esterified and heated in basic solution to yield sodium erythorbate.
Upon acidification of the salt in a water-methanol solution, Isoascorbic acid is formed.

Production Methods of Isoascorbic acid:
Isoascorbic acid is synthesized by the reaction between methyl 2- keto-D-gluconate and sodium methoxide.
Isoascorbic acid can also be synthesized from sucrose, and produced from Penicillium spp.

Biotechnological Production of Isoascorbic acid:
Yeasts and other fungi synthesize the C5 sugar acid D-erythroascorbic acid which shares structural and physicochemical properties with Asc.
D-erythroascorbic acid serves similar protective functions in these microorganisms as Asc does in plants and animals, including the scavenging of reactive oxygen species.

The biosynthesis of D-erythroascorbic acid starts from D-arabinose obtained by the microorganism from decaying plant material.
D-arabinose, presumably in Isoascorbic acid 1,4-furanosidic isomeric form, is oxidized by NAD(P)+ specific dehydrogenases to D-arabinono-1,4-lactone, which is further oxidized to D-erythroascorbic acid by D-arabinono-1,4-lactone oxidase.
Resting cells of Saccharomyces cerevisiae can synthesize Asc from L-galactose, L-galactono-1,4-lactone, or L-gulono- 1,4-lactone via the pathway naturally used for D-erythroascorbic acid.

Purification Methods of Isoascorbic acid:
Crystallise D(-)-isoascorbic acid from H2O, EtOH or dioxane. is at 245nm with 7,500 (EtOH).
Isoascorbic acid Used in various foods as water-soluble antioxidant to prevent change (color, taste, fragrance) of food occurred by oxidation.

Isoascorbic acid is found in frozen seafood, fishery product, stock meat, stock fish sausage, fruit, vegetable, pickles, beverage, gerry pet food etc.
Isoascorbic acid is also used as Oxygen absorbers (Sponge cake, Confectionery), boiler oxygen scavenger, photographic developer, hair dye and reaction-catalyst in resin polymerization.

Incompatibilities of Isoascorbic acid:
Isoascorbic acid is incompatible with chemically active metals such as aluminum, copper, magnesium, and zinc.
Isoascorbic acid is also incompatible with strong bases and strong oxidizing agents.

Isoascorbic acid, a stereoisomer of ascorbic acid with similar physicochemical properties, is widely used as an antioxidant in processed foods.
Isoascorbic acid or erythorbate, formerly known as iso ascorbic acid and D-arabo ascorbic acid, is a stereoisomer of ascorbic acid.

Isoascorbic acids chemical properties have many similarities with Vc, but as an antioxidant, Isoascorbic acid has the inimitable advantage that Vc do not have:
First, Isoascorbic acid is superior to the anti-oxidation than Vc, therefore, mixed the Vc, Isoascorbic acid can effectively protect the properties Vc component in improving the properties have very good results, while protecting the Vc color.
Second, higher security, no residue in the human body, participating in metabolism after absorb by human body, which can be transformed into Vc partially.

Isoascorbic acid, an epimer of L-ascorbic acid, is used in the United States as a food additive.
Studies were conducted to determine whether the ingestion of Isoascorbic acid in the diet had any beneficial or adverse effects on the human requirement for vitamin C.

Young women were fed diets that contained controlled amounts of Isoascorbic acid and ascorbic acid.
In pharmacokinetic evaluations, Isoascorbic acid and ascorbic acid were rapidly absorbed with little interaction.

Isoascorbic acid cleared from the body more rapidly than ascorbic acid. Some subjects received diets deficient in vitamin C for periods < or = 30 d.
Increasing intakes of Isoascorbic acid or prolonged intakes of < or = 1 g Isoascorbic acid/d did not indicate any interactions with ascorbic acid.

Consumption of Isoascorbic acid resulted in the presence of Isoascorbic acid in mononuclear leukocytes.
Ascorbic acid concentrations in these cells were not affected by the presence of Isoascorbic acid.

Isoascorbic acid disappeared quickly from these cells with cessation of Isoascorbic acid supplements.
Prolonged ingestion of erythrobic acid by young women neither antagonized nor spared their vitamin C status.

Storage of Isoascorbic acid:
Isoascorbic acid should be stored in an airtight container, protected from light, in a cool, dry place.

Stability and Reactivity of Isoascorbic acid:

Reactivity:

The following applies in general to flammable organic substances and mixtures:
In correspondingly fine distribution, when whirled up a dust explosion potential may generally be assumed.

Chemical stability:
Isoascorbic acid is chemically stable under standard ambient conditions (room temperature).

Incompatible materials:
Strong oxidizing agents, Strong bases, Chemically active metals, Aluminum, Zinc, Magnesium, Copper

Safety of Isoascorbic acid:
Isoascorbic acid is widely used in food applications as an antioxidant.
Isoascorbic acid is also used in oral pharmaceutical applications as an antioxidant.

Isoascorbic acid is generally regarded as nontoxic and nonirritant when used as an excipient.
Isoascorbic acid is readily metabolized and does not affect the urinary excretion of ascorbic acid.
The WHO has set an acceptable daily intake of Isoascorbic acid and Isoascorbic acid sodium salt in foods at up to 5 mg/kg body-weight.

First Aid of Isoascorbic acid:

Eye contact:
After initial flushing, remove any contact lenses and continue flushing for at least 15 minutes.
Get medical attention if irritation develops or persists.

Skin contact:
Wash affected area immediately with large amounts of soap and water.
Get medical attention if irritation develops or persists.

Inhalation:
Remove to fresh air, treat symptomatically.
Get medical attention if cough or other symptoms develop.

Ingestion:
If swallowed, do not induce vomiting.
Give milk or water.

Never give anything by mouth to an unconscious person.
Call a physician or poison control center immediately

Safeguards (Personnel):
If excessive dust is created, wear dust mask or respirator to keep exposure below the permissible exposure level for particulate matter.
Wear appropriate personal protective equipment.

Initial containment:
Take up and place in secure closed containers.
Treat or dispose of waste material in accordance with all local, state/provincial, and national requirements.
Pick up and arrange disposal without creating dust.

Large spills procedure:
Avoid dust generation.
Treat or dispose of waste material in accordance with all local, state/provincial, and national requirements.

Small spills procedure:
Do not dry sweep.
Treat or dispose of waste material in accordance with all local, state/provincial, and national requirements.

Handling (personnel):
Wash hands thoroughly after handling.
Avoid contact with eyes, skin, and clothing.
Avoid breathing (dust, vapor, mist, gas).

Handling (physical aspects):
Store in original container protected from direct sunlight in a dry, cool and well-ventilated area, away from incompatible materials.
Secure container after each use.

Storage precautions:
Keep dry.

Engineering controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower.
Good general ventilation should be sufficient to control airborne levels.
Ensure adequate ventilation, especially in confined areas.

Eye / face protection requirements:
A respiratory protection program that meets osha's 29 cfr 1910-134 and ansi z88-2 requirements must be followed whenever workplace conditions warrant a respirator's use.

Skin protection requirements:
Apron is recommended.
Wear protective gloves to minimize skin contamination.
Wash hands thoroughly after handling.

Respiratory protection requirements:
If airborne concentrations exceed the osha twa, a niosh approved dust mask is recommended.

Identifiers of Isoascorbic acid:
CAS Number: 89-65-6
CHEBI: 51438
ChemSpider: 16736142
ECHA InfoCard: 100.001.753
E number: E315 (antioxidants)
PubChem CID: 6981
UNII: 311332OII1
CompTox Dashboard (EPA): DTXSID6026537
Chemical formula: C6H8O6
Molar mass: 176.124 g·mol−1
Density: 0.704 g/cm3
Melting point: 164 to 172 °C (327 to 342 °F; 437 to 445 K)

Empirical Formula (Hill Notation): C6H8O6
CAS Number: 89-65-6
Molecular Weight: 176.12
Beilstein: 84271
EC Number: 201-928-0
MDL number: MFCD00005378
PubChem Substance ID: 24888398
NACRES: NA.22

CAS: 89-65-6
Molecular Formula: C6H7NaO6
Molecular Weight (g/mol): 198.11
MDL Number: MFCD00005378
InChI Key: IFVCRSPJFHGFCG-HXPAKLQESA-N
PubChem CID: 54675810
ChEBI: CHEBI:51438
IUPAC Name: (2R)-2-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one
SMILES: [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O

Properties of Isoascorbic acid:
Boiling point: 227.71°C (rough estimate)
Density: 1.3744 (rough estimate)
Refractive index: -17.5 ° (C=10, H2O)
Storage temp.: Store at 0-5°C
Solubility H2O: 0.1 g/mL, clear, colorless to very faintly yellow
Form: Crystals or Crystalline Powder
pka4.09±0.10(Predicted)
Color White to slightly yellow
Optical activity:[α]25/D 16.8°, c = 2 in H2O
Water Solubility: 1g/10mL
Merck: 14,5126
BRN: 84271
Stability: Stable. Combustible.
Incompatible: with chemically active metals, aluminium, zinc, copper, magnesium, strong bases, strong oxidizing agents.
InChIKey: CIWBSHSKHKDKBQ-JLAZNSOCSA-N

Appearance: White to slightly yellow crystalline solid which darkens gradually on exposure to light.
Other names: D-Isoascorbic acid; D-Araboascorbic acid
CAS number: 89-65-6
Chemical formula: C6H8O6
Molecular weight: 176.13
PKa: Isoascorbic acid is a diprotic acid having pKa’s 11.34 and 4.04.
Solubility
In water: 40 g in 100 mL water at 25 °C.
In organic solvents: Soluble in alcohol, pyridine; moderately soluble in acetone; slightly soluble in glycerol
CAS number: 89-65-6
EINECS, EC No.: 201-928-0
HS Code: 2932290090
Molecular formula: C6H8O6
Molecular weight: 176.13 g/mol

Quality Level: 200
Assay: 98%
Form: crystals
Optical activity: [α]25/D −16.8°, c = 2 in H2O
mp: 169-172 °C (dec.) (lit.)
SMILES string: [H][C@@]1(OC(=O)C(O)=C1O)[C@H](O)CO
InChI: 1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5-/m1/s1
InChI key: CIWBSHSKHKDKBQ-DUZGATOHSA-N

Molecular Weight: 176.12 g/mol
XLogP3: -1.6
Hydrogen Bond Donor Count: 4
Hydrogen Bond Acceptor Count: 6
Rotatable Bond Count: 2
Exact Mass: 176.03208797 g/mol
Monoisotopic Mass: 176.03208797 g/mol
Topological Polar Surface Area: 107Ų
Heavy Atom Count: 12
Complexity: 232
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 2
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 Isoascorbic acid:
Form: solid
Color: white
Odor: none
Boiling point: nd c
Vapor pressure: nd psia
Vapor density: nd (air = 1)
Solubility in water: 40 g/100 ml
Specific gravity: 1.65 (water = 1)
Bulk density: nd
Melting/freezing point: nd c
Ph: 5-6
% volatiles: nd %

Identification: Passes Test
Appearance: White odorless crystalline powder.
Assay: 99.0 - 100.5%
Specific Rotation, [a ]25°/D °C: Between -16.5° and -18.0°
Heavy Metals: 10 ppm max
Lead: 5 ppm max
ArseniC: 3 ppm max
Residue on Ignition,: >0.3% max
Loss on Drying: 0.4% max
Packing: 25-kg (55-lb) or as required by the buyer

Melting Point: 169°C to 172°C (decomposition)
Odor: Odorless
Quantity: 100 g
Merck Index: 14,5126
Solubility Information: Soluble in alcohol, pyridine and water.
Formula Weight: 176.12
Percent Purity: 99%
Physical Form: Powder
Chemical Name or Material: D-(-)-Isoascorbic acid

Related Products of Isoascorbic acid:
N,N-Diethyl-2,2,2-trifluoroacetamide
N,N-Dimethylpiperidine-4-sulfonamide Hydrochloride
Des-4-methylenepiperidine Efinaconazole
2,3-Difluorophenyl Efinaconazole Diol
3-Isobutylaniline

Synonyms of Isoascorbic acid:
Isoascorbic acid
Isoascorbic acid
D-Isoascorbic acid
89-65-6
D-Araboascorbic acid
Araboascorbic acid
D-Isoascorbic acid
Isovitamin C
2,3-Didehydro-D-erythro-hexono-1,4-lactone
Erycorbin
Neo-cebicure
UNII-311332OII1
Saccharosonic acid
Glucosaccharonic acid
MFCD00005378
(5R)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxyfuran-2(5H)-one
D-erythro-Hex-2-enonic acid, g-lactone
D-erythro-hex-2-enonic acid gamma-lactone
D-(-)-Isoascorbic acid
CHEBI:51438
(R)-5-((R)-1,2-dihydroxyethyl)-3,4-dihydroxyfuran-2(5H)-one
D-ASCORBIC ACID, ISO
D-erythro-hex-2-enono-1,4-lactone
311332OII1
Mercate 5
D(-)-Isoascorbic acid, 98%
D-erythro-Hex-2-enonic acid, .gamma.-lactone
Erythroascorbic acid, D-
FEMA Number: 2410
FEMA No. 2410
CCRIS 6568
HSDB 584
Isoascorbic acid [NF]
D-erythro-Hex-2-enonic acid, gamma-lactone
NSC 8117
D-erythro-3-Oxohexonic acid lactone
EINECS 201-928-0
D-erythro-3-Ketohexonic acid lactone
3-Oxohexonic acid lactone, D-erythro-
BRN 0084271
3-Keto-D-erythro-hexonic acid gamma-lactone
Hex-2-enonic acid gamma-lactone, D-erythro-
d-iso-ascorbic acid
1f9g
E315
D-Erythro-hex-2-enonic acid, gamma-lactone,
DSSTox_CID_6537
D-(-)-Araboascorbic acid
EC 201-928-0
DSSTox_RID_78143
D-(???)-Isoascorbic acid
DSSTox_GSID_26537
SCHEMBL18678
5-18-05-00026 (Beilstein Handbook Reference)
CHEMBL486293
SCHEMBL3700961
DTXSID6026537
D-(-)-Isoascorbic acid, 98%
(2R)-2-[(1R)-1,2-dihydroxyethyl]-4,5-dihydroxyfuran-3-one
HY-N7079
Tox21_201111
SBB017515
AKOS015856346
ZINC100006772
ZINC100057602
CAS-89-65-6
D-erythro-hex-2-enoic acid ??-lactone
NCGC00258663-01
D-Isoascorbic acid, >=99%, FCC, FG
O272
A0520
CS-0014152
C20364
Q424531
J-506944
7179C406-7CCF-4C07-9125-AA71E28FB983
(2R)-2-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one
(5R)-5-(1,2-dihydroxyethyl)-3,4-dihydroxy-5-hydrofuran-2-one
Isoascorbic acid, United States Pharmacopeia (USP) Reference Standard
(5R)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxyfuran-2(5H)-one (non-preferred name)
Isoascorbic Acid
D-araboascorbic Acid
Araboascorbic Acid
D-Isoascorbic acid
Isovitamin C
D-isoascorbic Acid
Erycorbin
Neo-cebicure
Saccharosonic Acid
Mercate 5
Glucosaccharonic Acid
D-(-)-isoascorbic Acid
Erythroascorbic Acid, D-
Fema Number: 2410
D-ascorbic Acid, Iso
Fema No. 2410
Ccris 6568
Hsdb 584
D-erythro-hex-2-enonic Acid, Gamma-lactone
2,3-didehydro-d-erythro-hexono-1,4-lactone
Unii-311332oii1
Chebi:51438
89-65-6
Nsc 8117
D-erythro-3-oxohexonic Acid Lactone
Einecs 201-928-0
D-erythro-3-ketohexonic Acid Lactone
3-oxohexonic Acid Lactone, D-erythro-
Brn 0084271
E315
(5r)-5-[(1r)-1,2-dihydroxyethyl]-3,4-dihydroxyfuran-2(5h)-one
3-keto-d-erythro-hexonic Acid Gamma-lactone
D-erythro-hex-2-enonic Acid, Gamma-lactone,
Hex-2-enonic Acid Gamma-lactone, D-erythro-
Erythroascorbic Acid
D-erythro-hex-2-enoic Acid Gamma-lactone
D-erythro-hex-2-enonic Acid, .gamma.-lactone
Erythorbatd
D-erythro-hex-1-enofuranos-3-ulose
Isoascorbic acid [nf]
1f9g
Ac1l1nqg
Dsstox_cid_6537
Dsstox_rid_78143
Dsstox_gsid_26537
Schembl18678
W241008_aldrich
856061_aldrich
Chembl486293
Schembl3700961
58320_fluka
Ciwbshskhkdkbq-duzgatohsa-n
Molport-003-937-345
7378-23-6 (hydrochloride Salt)
Tox21_201111
Ar-1i3651
D-erythro-hex-2-enono-1,4-lactone
Sbb017515
146-75-8 (di-hydrochloride Salt)
Akos015856346
311332oii1
Ls-2352
Rl05634
Cas-89-65-6
6381-77-7 (mono-hydrochloride Salt)
Ncgc00258663-01
Kb-49577
O272
D-erythro-hex-2-enonic Acid Gamma-lactone
A0520
C20364
5-18-05-00026 (beilstein Handbook Reference)
(2r)-2-[(1r)-1,2-dihydroxyethyl]-4,5-dihydroxyfuran-3-one
7179c406-7ccf-4c07-9125-aa71e28fb983
(5r)-5-(1,2-dihydroxyethyl)-3,4-dihydroxy-5-hydrofuran-2-one
74242-57-2
Erythorbic acid
ISOASCORBIC-ACID
1f9g
E315
D-Erythro-hex-2-enonic acid, gamma-lactone,
EC 201-928-0
SCHEMBL18678
ERYTHORBIC ACID [II]
5-18-05-00026 (Beilstein Handbook Reference)
ERYTHORBIC ACID [FCC]
ISOASCORBIC ACID [MI]
ERYTHORBIC ACID [FHFI]
ERYTHORBIC ACID [HSDB]
ERYTHORBIC ACID [INCI]
CHEMBL486293
DTXCID306537
INS NO.315
SCHEMBL3700961
ERYTHORBIC ACID [MART.]
ERYTHORBIC ACID [USP-RS]
INS-315
D-(-)-Isoascorbic acid, 98%
HY-N7079
Tox21_201111
AC8021
AKOS015856346
D-erythro-hex-2-enoic acid ?-lactone
CAS-89-65-6
D-erythro-Hex-2-enonic acid, g-lactone
NCGC00258663-01
D-erythro-Hex-2-enoic acid gamma-lactone
D-Isoascorbic acid, >=99%, FCC, FG
A0520
CS-0014152
E-315
ASCORBIC ACID IMPURITY F [EP IMPURITY]
C20364
EN300-251979
A843272
Q424531
D-Isoascorbic acid 1000 microg/mL in Acetonitrile
J-506944
Z1255372411
7179C406-7CCF-4C07-9125-AA71E28FB983
Erythorbic acid, United States Pharmacopeia (USP) Reference Standard
(5R)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one
(5R)-5-[(1R)-1,2-Dihydroxyethyl]-3,4-dihydroxyfuran-2(5H)-one (D-Isoascorbic Acid)

DESCRIPTION:

Erythorbic acid (isoascorbic acid, D-araboascorbic acid) is a stereoisomer of ascorbic acid (vitamin C).
Isoascorbic Acid (Erythorbic Acid) is synthesized by a reaction between methyl 2-keto-D-gluconate and sodium methoxide.
Isoascorbic Acid (Erythorbic Acid) can also be synthesized from sucrose or by strains of Penicillium that have been selected for this feature.[2]
Isoascorbic Acid (Erythorbic Acid) is denoted by E number E315, and is widely used as an antioxidant in processed foods.[3]


CAS: 89-65-6
European Community (EC) Number: 201-928-0
IUPAC name: D-erythro-Hex-2-enono-1,4-lactone
Molecular Formula: C6H8O6

SYNONYMS OF ISOASCORBIC ACID (ERYTHORBIC ACID):
D-araboascorbic acid,erythorbic acid,erythroascorbic acid,isoascorbic acid,isoascorbic acid, disodium salt,isoascorbic acid, monosodium salt,isoascorbic acid, sodium salt,sodium erythorbate,Erythorbic acid,Isoascorbic acid,D-Araboascorbic acid,89-65-6,D-Isoascorbic acid,Araboascorbic acid,D-Erythorbic acid,Isovitamin C,D-(-)-Isoascorbic acid,Saccharosonic acid,Glucosaccharonic acid,2,3-Didehydro-D-erythro-hexono-1,4-lactone,FEMA No. 2410,(R)-5-((R)-1,2-dihydroxyethyl)-3,4-dihydroxyfuran-2(5H)-one,Erycorbin,Neo-cebicure,D-erythro-Hex-2-enonic acid, .gamma.-lactone,D-erythro-Hex-2-enonic acid, g-lactone,D-erythro-hex-2-enonic acid gamma-lactone,DTXSID6026537,CHEBI:51438,(5R)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxyfuran-2(5H)-one,D-ASCORBIC ACID, ISO,D-erythro-hex-2-enono-1,4-lactone,311332OII1,D(-)-Isoascorbic Acid (Erythorbic Acid),(2R)-2-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one,Mercate 5,Erythroascorbic acid, D-,MFCD00005378,FEMA Number: 2410,CCRIS 6568,HSDB 584,D(-?)?-?Isoascorbic Acid (Erythorbic Acid),Erythorbic acid [NF],NSC 8117,D-erythro-3-Oxohexonic acid lactone,EINECS 201-928-0,D-erythro-3-Ketohexonic acid lactone,3-Oxohexonic acid lactone, D-erythro-,BRN 0084271,NSC-8117,3-Keto-D-erythro-hexonic acid gamma-lactone,Hex-2-enonic acid gamma-lactone, D-erythro-,(5R)-5-((1R)-1,2-DIHYDROXYETHYL)-3,4-DIHYDROXYFURAN-2(5H)-ONE,UNII-311332OII1,D-soascorbic acid,(5R)-5-[(1R)-1,2-Dihydroxyethyl]-3,4-dihydroxyfuran-2(5H)-one (D-Isoascorbic Acid); Ascorbic Acid Impurity F; Sodium Ascorbate Impurity F,d-iso-ascorbic acid
ERYTHORBATE,ISOASCORBIC-ACID,1f9g,E315,D-Erythro-hex-2-enonic acid, gamma-lactone,,EC 201-928-0,SCHEMBL18678,ERYTHORBIC ACID [II],5-18-05-00026 (Beilstein Handbook Reference),ERYTHORBIC ACID [FCC],ISOASCORBIC ACID [MI],ERYTHORBIC ACID [FHFI],ERYTHORBIC ACID [HSDB],CHEMBL486293,DTXCID306537,INS NO.315,SCHEMBL3700961,ERYTHORBIC ACID [MART.],ERYTHORBIC ACID [USP-RS],INS-315,D-(-)-Isoascorbic acid, 98%,HY-N7079,Tox21_201111,AC8021,AKOS015856346,D-erythro-hex-2-enoic acid ?-lactone,CAS-89-65-6,NCGC00258663-01,D-erythro-Hex-2-enoic acid gamma-lactone,D-Isoascorbic acid, >=99%, FCC, FG,A0520,CS-0014152,E-315,NS00079026,ASCORBIC ACID IMPURITY F [EP IMPURITY],C20364,EN300-251979,A843272,Q424531,D-Isoascorbic acid 1000 microg/mL in Acetonitrile,J-506944,Z1255372411,7179C406-7CCF-4C07-9125-AA71E28FB983,Erythorbic acid, United States Pharmacopeia (USP) Reference Standard,(5R)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one,(5R)-5-[(1R)-1,2-Dihydroxyethyl]-3,4-dihydroxyfuran-2(5H)-one (D-Isoascorbic Acid),(5R)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxyfuran-2(5H)-one (non-preferred name)


Isoascorbic acid is used as antioxidant especially in brewing industry, reducing agent in photography.
And Isoascorbic Acid (Erythorbic Acid) is also used in food industry, as food additives.
Erythorbic acid is a natural product found in Hypsizygus marmoreus, Grifola frondosa, and other organisms with data available.
D-isoascorbic acid is an ascorbic acid.

Erythorbic acid (D-Isoascorbic acid), produced from sugars derived from different sources, such as beets, sugar cane, and corn, is a food additive used predominantly in meats, poultry, and soft drinks.


Erythorbic Acid, formerly known as isoAscorbic Acid and D-araboAscorbic Acid, is a stereoisomer of Ascorbic Acid (Vitamin C).
Isoascorbic Acid (Erythorbic Acid) is a vegetable-derived food additive produced from sucrose.
Isoascorbic Acid (Erythorbic Acid) is often used to preserve fresh produce as well as cured meat and frozen vegetables.

Ascorbyl Palmitate, Ascorbyl Dipalmitate and Ascorbyl Stearate are made from vitamin C (ascorbic acid).
Erythorbic Acid and Sodium Erythorbate are substances with structures similar to vitamin C and the sodium salt of vitamin C.
Ascorbyl Palmitate, Ascorbyl Dipalmitate and Ascorbyl Stearate are used primarily in makeup products.
Erythorbic Acid and Sodium Erythorbate are used primarily in hair and nail products.

Clinical trials have been conducted to investigate aspects of the nutritional value of erythorbic acid.
One such trial investigated the effects of erythorbic acid on vitamin C metabolism in young women; no effect on vitamin C uptake or clearance from the body was found.
A later study found that erythorbic acid is a potent enhancer of nonheme-iron absorption.


Since the U.S. Food and Drug Administration banned the use of sulfites as a preservative in foods intended to be eaten fresh (such as salad bar ingredients), the use of erythorbic acid as a food preservative has increased.
Isoascorbic Acid (Erythorbic Acid) is also used as a preservative in cured meats and frozen vegetables.[6]
Isoascorbic Acid (Erythorbic Acid) was first synthesized in 1933 by the German chemists Kurt Maurer and Bruno Schiedt


CHEMICAL AND PHYSICAL PROPERTIES OF ISOASCORBIC ACID (ERYTHORBIC ACID):
Chemical formula C6H8O6
Molar mass 176.124 g•mol−1
Density 0.704 g/cm3
Melting point 164 to 172 °C (327 to 342 °F; 437 to 445 K) (decomposes)
Acidity (pKa) 2.1
CAS Number
89-65-6 check
3D model (JSmol)
Interactive image
ChEBI
CHEBI:51438 check
ChemSpider
16736142 check
ECHA InfoCard 100.001.753 Edit this at Wikidata
E number E315 (antioxidants, ...)
PubChem CID
6981
UNII
311332OII1 check
CompTox Dashboard (EPA)
DTXS
Molecular Weight
176.12 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
XLogP3
-1.6
Computed by XLogP3 3.0 (PubChem release 2021.10.14)
Hydrogen Bond Donor Count
4
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Hydrogen Bond Acceptor Count
6
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Rotatable Bond Count
2
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Exact Mass
176.03208797 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Monoisotopic Mass
176.03208797 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Topological Polar Surface Area
107Ų
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
232
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Isotope Atom Count
0
Computed by PubChem
Defined Atom Stereocenter Count
2
Computed by PubChem
Undefined Atom Stereocenter Count
0
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
Description
Erythorbic acid (D-Isoascorbic acid), produced from sugars derived from different sources, such as beets, sugar cane, and corn, is a food additive used predominantly in meats, poultry, and soft drinks.

Molecular Weight
176.12

Formula
C6H8O6

CAS No.
89-65-6

Appearance
Solid

Color
Off-white to light yellow

SMILES
O=C1C(O)=C(O)[C@]([C@H](O)CO)([H])O1

Structure Classification
Others
Initial Source
Microorganisms
Flammulina velutipes

Shipping
Room temperature in continental US; may vary elsewhere.

Storage
4°C, protect from light, stored under nitrogen


SAFETY INFORMATION ABOUT ISOASCORBIC ACID (ERYTHORBIC 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.

Isoascorbic Acid; D-erythro-Hex-2-enoic acid γ-lactone; D-Araboascorbic acid; Erythorbic acid; Glucosaccharonic acid; NSC 8117; cas no: 89-65-6

Isoborneol, also known as borneol, belongs to the class of organic compounds known as bicyclic monoterpenoids.
Isoborneol is a monoterpenoid alcohol present in the essential oils of numerous medicinal plants and has antioxidant and antiviral properties.
Isoborneol is used as a synthetic flavor, as a moth repellent, cold sore topical medication, muscle liniment, and steam-inhaled cough suppressant.

CAS Number: 124-76-5
EC Number: 204-712-4
Molecular Formula: C10H18O
Molecular Weight (g/mol): 154.253

Isoborneol is a bicyclic organic compound and a terpene derivative.
The hydroxyl group in this compound is placed in an exo position.

The endo diastereomer is called borneol.
Being chiral, isoborneol exists as enantiomers.

Isoborneol ((±)-Isoborneol) is a monoterpenoid alcohol present in the essential oils of numerous medicinal plants and has antioxidant and antiviral properties.
Isoborneol is a potent inhibitor of herpes simplex virus type 1 (HSV-1)

Isoborneol, also known as borneol, belongs to the class of organic compounds known as bicyclic monoterpenoids.
These are monoterpenoids containing exactly 2 rings, which are fused to each other.

Monoterpenoids are terpenes that contain 10 carbon atoms and are comprised of two isoprene units.
The biosynthesis of monoterpenes is known to occur mainly through the methyl-eritritol-phosphate (MEP) pathway in the plastids.

Geranyl diphosphate (GPP) is a key intermediate in the biosynthesis of cyclic monoterpenes.
GPP undergoes several cyclization reactions to yield a diverse number of cyclic arrangements.

Borneol can be synthesized by reducing camphor by the Meerwein‚ ÄìPonndorf‚ ÄìVerley reaction, a reversible, inexpensive process.
The isomer isoborneol can be produced in the kinetically controlled reduction of camphor with sodium borohydride, which is fast and irreversible.
(-)-Isoborneol is neutral compound, a white crystalline solid with a balsamic camphoreous herbal woody odor and camphoreous minty herbal earthy woody flavor.

Borneol or isoborneol is a naturally occurring organic compound found in the essential oil of many plants such as camphorweed, mugwort, beautyberry, Ngai camphor, aromatic ginger.

Isoborneol is used as a synthetic flavor, as a moth repellent, cold sore topical medication, muscle liniment, and steam-inhaled cough suppressant.
Isoborneol is also used in Used in perfumes.

Isoborneol, also known as isobornyl alcohol, belongs to the class of organic compounds known as bicyclic monoterpenoids.
These are monoterpenoids containing exactly 2 rings, which are fused to each other.
Based on a literature review a small amount of articles have been published on Isoborneol.

Isoborneol is a terpene derivative.
Isoborneol is prepared by hydration and rearrangement of camphene/pinene.
Isoborneol is commonly used as flavor and fragrance agents

Applications of Isoborneol:
Isoborneol is used in fragrance formulation of daily chemicals
Isoborneol is used in daliy and industrial flavor

Isoborneol is used in producing rosemary and lavandula angustifolia
Isoborneol is used as antiseptics.

Isoborneol is used as a synthetic flavor, as a moth repellent, cold sore topical medication, muscle liniment, and steam-inhaled cough suppressant.
Isoborneol is also used in Used in perfumes.

Uses of Isoborneol:
Isoborneol is used as a synthetic flavor.
In over-the-counter preparations containing <11% camphor, Isoborneol has been used as a moth repellent, cold sore topical medication, muscle liniment, and steam-inhaled cough suppressant.
Isoborneol is used in perfumes.

The repellence of the plant-derived bicyclic monoterpenoid isoborneol on subterranean termites was assessed in short-term laboratory bioassays.
Depending on concentration, application of isoborneol to different soil types was efficient in creating repellent soil barriers, which were not penetrated by workers of Reticulitermes santonensis De Feytaud or R. flavipes Kollar within 2 wk after adding Isoborneol to the substrate.

Isoborneol-treated barriers did not affect termite survival.
The bioavailability of the active ingredient decreased with increasing clay content of the soil.
Evaporation of isoborneol from treated soil increased with increasing particle size of the substrate and could be reduced by covering the soil surface.

Industry Uses:
Fragrance Ingredients
Odor agents
Odor agents
Other (specify)

Consumer Uses:
Air care products
Cleaning and furnishing care products
Laundry and dishwashing products
Non-TSCA use
Personal care products
Plastic and rubber products not covered elsewhere
Fragrance
Odor agents

Solubility of Isoborneol:
Insoluble in water.
Soluble in dipropylene glycol, ethyl alcohol (1gm. in 2ml. 70% alcohol).

Preparation of Isoborneol:
Isoborneol is synthesized commercially by hydrolysis of isobornyl acetate.
The latter is obtained from treatment of camphene with acetic acid in the presence of a strong acid catalyst.

Isoborneol can also be produced by reduction of camphor.

Isoborneol derivatives as chiral ligands:
Derivatives of isoborneol are used as ligands in asymmetric synthesis.

(2S)-(−)-3-exo-(morpholino)isoborneol or MIB with a morpholine substituent in the α-hydroxyl position.
(2S)-(−)-3-exo-(dimethylamino)isoborneol or DAI with a dimethylamino substituent in the α-hydroxyl position

Absorption, Distribution and Excretion of Isoborneol:
The percutaneous absorptions of camphene, isoborneol-acetate, limonene, menthol and alpha-pinene as constituents of a foam bath (Pinimenthol) were measured on animals using radioactively labeled ingredients.
Pharmacokinetic measurements showed maximum blood levels for all tested ingredients 10 min after the onset of percutaneous absorption.

None of the ingredients was preferentially absorbed.
Blood levels of all ingredients after 10 min of percutaneous absorption were a direct function of the size of the skin area involved.

Manufacturing Methods of Isoborneol:
By hydrolysis of isobornyl acetate, or by catalytic reduction of camphor (both d- and l-isomers); the optically inactive compound can be prepared by treating camphene with 1:1 mixture of sulfuric acid and glacial acetic acid and then hydrolyzing the isobornyl acetate.

General Manufacturing Information of Isoborneol:

Industry Processing Sectors:
All Other Chemical Product and Preparation Manufacturing
Plastics Material and Resin Manufacturing
Soap, Cleaning Compound, and Toilet Preparation Manufacturing

Analytic Laboratory Methods of Isoborneol:

Method: USGS-NWQL O-1433-01; Procedure: gas chromatography/mass spectrometry.
Analyte: isoborneol.
Matrix: filtered wastewater and natural-water samples.
Detection Limit: 0.11 ug/L.

Method: USGS-NWQL O-4433-06.
Procedure: continuous liquid-liquid extractor with gas chromatography with mass spectrometry detection.
Analyte: isoborneol.
Matrix: whole wastewater and environmental water samples.
Detection Limit: 0.05 ug/L.

Gas chromatography (GC)-NMR method is described for detecting isoborneol in commercial borneol preparations.

Isoborneol detected by chromatographic analysis with previous absorption.
Determination was made by internal reference method with naphthalene as reference.

Resolution of chiral compounds has played an important role in the pharmaceutical field, involving detailed studies of pharmacokinetics, physiological, toxicological, and metabolic activities of enantiomers.
Herein, a reliable method by high-performance liquid chromatography (HPLC) coupled with an optical rotation detector was developed to separate isoborneol enantiomers.

A cellulose tris(3, 5-dimethylphenylcarbamate)-coated chiral stationary phase showed the best separation performance for isoborneol enantiomers in the normal phase among four polysaccharide chiral packings.
The effects of alcoholic modifiers and column temperature were studied in detail.

Resolution of the isoborneol racemate displayed a downward trend along with an increase in the content of ethanol and column temperature, indicating that less ethanol in the mobile phase and lower temperature were favorable to this process.
Moreover, two isoborneol enantiomers were obtained via a semipreparative chiral HPLC technique under optimum conditions, and further characterized by analytical HPLC, and experimental and calculated vibrational circular dichroism (VCD) spectroscopy, respectively.

The solution VCD spectrum of the first-eluted component was consistent with the Density Functional Theory (DFT) calculated pattern based on the SSS configuration, indicating that this enantiomer should be (1S, 2S, 4S)-(+)-isoborneol.
Briefly, these results have provided reliable information to establish a method for analysis, preparative separation, and absolute configuration of chiral compounds without typical chromophoric groups.

Handling and Storage of Isoborneol:

Storage Conditions:
Keep container tightly closed in a dry and well-ventilated place.
Keep in a dry place.

Storage of Isoborneol:
Avoid contact with light
Keep separated from incompatible substances

Store and handle in accordance with all current regulations and standards
Store in a cool, dry place
Store in a tightly closed container

Fire Fighting of Isoborneol:

Suitable extinguishing media:
Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide.

Advice for firefighters:
Wear self-contained breathing apparatus for firefighting if necessary.

Further information:
Use water spray to cool unopened containers.

Accidental Release Measures of Isoborneol:

Personal precautions, protective equipment and emergency procedures:
Use personal protective equipment.
Avoid dust formation.

Avoid breathing vapors, mist or gas.
Ensure adequate ventilation.

Remove all sources of ignition.
Evacuate personnel to safe areas.
Avoid breathing dust.

Environmental precautions:
Prevent further leakage or spillage if safe to do so.
Do not let Isoborneol enter drains.

Methods and materials for containment and cleaning up:
Sweep up and shovel.
Contain spillage, and then collect with an electrically protected vacuum cleaner or by wetbrushing and place in container for disposal according to local regulations.

Keep in suitable, closed containers for disposal.
Contain spillage, pick up with an electrically protected vacuum cleaner or by wet-brushing and transfer to a container for disposal according to local regulations.

Disposal Methods of Isoborneol:
Recycle any unused portion of Isoborneol for its approved use or return Isoborneol to the manufacturer or supplier.

Ultimate disposal of the chemical must consider:
Isoborneol's impact on air quality; potential migration in air, soil or water; effects on animal, aquatic and plant life; and conformance with environmental and public health regulations.
If Isoborneol is possible or reasonable use an alternative chemical product with less inherent propensity for occupational harm/injury/toxicity or environmental contamination.

Burn in a chemical incinerator equipped with an afterburner and scrubber but exert extra care in igniting as Isoborneol is highly flammable.
Offer surplus and non-recyclable solutions to a licensed disposal company.
Contact a licensed professional waste disposal service to dispose of Isoborneol.

Contaminated packaging:
Dispose of as unused Isoborneol.

Identifiers of Isoborneol:
CAS Number:
+: 16725-71-6 d
-: 10334-13-1
rac: 124-76-5

ChEBI +: CHEBI:191949

ChEMBL:
+: ChEMBL4294644
-: ChEMBL3560760

ChemSpider:
+: 16739225
-: 4882019

PubChem CID:
+: 6973640
-: 6321405

UNII:
+: 8GDX32M6KF
-: 20U67Z994U
rac: L88RA8N5EG

UN number: 1312
InChI +: InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8-,10+/m0/s1

Key:
DTGKSKDOIYIVQL-OYNCUSHFSA-N
Key -: InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8-,10+/m1/s1

Key: DTGKSKDOIYIVQL-MRTMQBJTSA-N

SMILES:
+: C[C@]12CC[C@H](C1(C)C)C[C@@H]2O
-: C[C@@]12CC[C@@H](C1(C)C)C[C@H]2O
rac: CC1(C2CCC1(C(C2)O)C)C

Empirical Formula (Hill Notation): C10H18O
CAS Number: 124-76-5
Molecular Weight: 154.25
EC Number: 204-712-4
MDL number: MFCD00074821
PubChem Substance ID: 24895930
NACRES: NA.22

CAS: 124-76-5
Molecular Formula: C10H18O
Molecular Weight (g/mol): 154.253
MDL Number: MFCD00074821
InChI Key: DTGKSKDOIYIVQL-SZBHIRRCSA-N
Synonym: dl-isoborneol
PubChem CID: 126961757
IUPAC Name: (1R,3R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol
SMILES: CC1(C2CCC1(C(C2)O)C)C

Properties of Isoborneol:
Chemical formula: C10H18O
Molar mass: 154.253 g·mol−1
Appearance: white or colorless solid
Melting point: 212–214 °C (414–417 °F; 485–487 K) + or -; 210–215 °C for rac

Quality Level: 100
Assay: 95%
mp: 212-214 °C (subl.) (lit.)
SMILES string: [H][C@@]12CC[C@@](C)([C@H](O)C1)C2(C)C
InChI: 1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8-,10+/m1/s1
InChI key: DTGKSKDOIYIVQL-MRTMQBJTSA-N

Formula: C10H18O
Purity: >70.0%(GC)
Color/Form: White to Almost white powder to crystal
InChI: InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3
InChI key: InChIKey=DTGKSKDOIYIVQL-UHFFFAOYSA-N
SMILES: CC1(C)C2CCC1(C)C(O)C2
MDL: MFCD00066426
Melting point: 201 °C
Flash point: 201 °C
HS code: 2906190090

Molecular Weight: 154.25 g/mol
XLogP3: 2.7
Hydrogen Bond Donor Count: 1
Hydrogen Bond Acceptor Count: 1
Rotatable Bond Count: 0
Exact Mass: 154.135765193 g/mol
Monoisotopic Mass: 154.135765193 g/mol
Topological Polar Surface Area: 20.2Ų
Heavy Atom Count: 11
Complexity: 185
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 3
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 Isoborneol:
Melting Point: ∼210°C (sublimation)
Flash Point: 74°C (165°F)
Odor: Strong
Quantity: 25 g
UN Number: UN1325
Beilstein: 4126091
Merck Index: 14,5128
Formula Weight: 154.25
Percent Purity: 95%
Chemical Name or Material: (±)-Isoborneol

Names of Isoborneol:

IUPAC name:
(1S,2S,4S)-1,7,7-trimethylbicyclo[2.2.1]heptane-2-ol, (1R,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptane-2-ol

Synonyms of Isoborneol:
Isoborneol
(-)-Isoborneol
124-76-5
DL-Isoborneol
Isocamphol
L-Isoborneol
Isobornyl alcohol
(-)-(2R)-Isoborneol
Isoborneol, (-)-
2-exo-Bornyl alcohol
10334-13-1
Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, (1R,2R,4R)-rel-
(-)-Bornan-2-exo-ol
FEMA No. 2158
(1R,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
Isoborneol (1R,2R,4R)-form [MI]
L88RA8N5EG
Exoborneol
DTXSID2042060
exo-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol
NSC 26350
20U67Z994U
exo-2-Hydroxy-1,7,7-trimethylnorbornane
Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, (1R,2R,4R)-
(1R,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2alpha-ol
Isoborneol, DL-
Isobomeol
Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, (1R,2R,4R)-rel-
2-Bornanol, exo-
2-Camphanol, exo-
exo-1,7,7-Trimethylbicyclo(2.2.1)heptan-2-ol
507-70-0
UNII-L88RA8N5EG
Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, exo-
b-Camphol
NSC-26350
UNII-20U67Z994U
HSDB 2843
EINECS 204-712-4
Isoborneol, 95%
BRN 4126091
ISOBORNEOL,DL-
ISOBORNEOL [MI]
AI3-14113
ISOBORNEOL [FCC]
ISOBORNEOL [FHFI]
ISOBORNEOL [HSDB]
Isoborneol, >=95%, FG
SCHEMBL115722
1,7,7-Trimethylbicyclo(2.2.1)heptan-2-ol, exo-
Isoborneol, analytical standard
ISOBORNEOL,(+/-)-
CHEMBL3560760
DTXCID0022060
FEMA 2158?
HY-N2004
Tox21_301645
MFCD00074821
AKOS028109482
NCGC00255879-01
BS-43851
CAS-124-76-5
CS-0018324
EN300-179986
EN300-760916
A828291
J-005169
Q15644616
(1R,3R,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanol
(1R,3R,4R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol
rac-(1R,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
rel-(1R,2R,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol
(1R*,2R*,4R*)-1,7,7-Trimethyl-bicyclo[2.2.1]heptan-2-ol
(-)-Isoborneol
(1R,2R,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol [ACD/IUPAC Name]
(1R,2R,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol [German] [ACD/IUPAC Name]
(1R,2R,4R)-1,7,7-Triméthylbicyclo[2.2.1]heptan-2-ol [French] [ACD/IUPAC Name]
10334-13-1 [RN]
124-76-5 [RN]
Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, (1R,2R,4R)-rel-
Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, (1R,2R,4R)- [ACD/Index Name]
exo-2-Borneol
exo-borneol
ISOBORNEOL [Wiki]
ISOBORNEOL, (-)-
(+)-Isoborneol
(1R,2R,4R)-1,7,7-trimethyl-2-norbornanol
(1R,2R,4R)-1,7,7-trimethylnorbornan-2-ol
(1R,2R,4R)-Isoborneol
(1R,2R,4R)-rel-1,7,7-trimethyl-bicyclo[2.2.1]heptan-2-ol
(1R,3R,4R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol
(1R,4R,6R)-1,7,7-trimethylbicyclo[2.2.1]heptan-6-ol
1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol [ACD/IUPAC Name]
10385-78-1 [RN]
507-70-0 [RN]
874571-72-9 [RN]
b-Camphol
Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, (1R,2R,4R)-rel-
Bicyclo[2.2.1]heptan-2-ol,1,7,7-trimethyl-, (1R,2R,4R)-rel-
exo-1,7,7-trimethylbicyclo(2.2.1)-2-heptanol
exo-1,7,7-Trimethylbicyclo(2.2.1)heptan-2-ol
exo-2-Bornanol
exo-2-Camphanol
iso-Camphol
Isocamphol
MFCD18086994 [MDL number]
missing
rac-(1R,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol

ISOBORNYL ACETATE, N° CAS : 125-12-2, Nom INCI : ISOBORNYL ACETATE, Nom chimique : Bicyclo[2.2.1]heptan-2-ol,1,7,7-trimethyl-, acetate, exo-, N° EINECS/ELINCS : 204-727-6, Ses fonctions (INCI). Agent masquant : Réduit ou inhibe l'odeur ou le goût de base du produit. Agent parfumant : Utilisé pour le parfum et les matières premières aromatiques. Noms français : 1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPTAN-2-OL ACETATE; ACETATE D'ISOBORNYLE; BICYCLO(2.2.1)HEPTAN-2-OL, 1,7,7-TRIMETHYL-, ACETATE, EXO-; ESTER ISOBORNYLIQUE DE ; L'ACIDE ACETIQUE. Noms anglais : ACETIC ACID, ISOBORNYL ESTER; BORNEOL ACETATE; ISOBORNEOL, ACETATE; ISOBORNYL ACETATE. Utilisation et sources d'émission : Fabrication de produits pharmaceutiques, agent de saveur

Isobornyl Acetate Isobornyl acetate (izobornil asetat, isobornyl acetate) readily hydrolyzes (within hours) to isobornyl alcohol during the first step of its biochemical pathway. The alcohol will become conjugated with glucoronic acid and be excreted in the urine (expected within hours to days). IDENTIFICATION: Isobornyl acetate (izobornil asetat, isobornyl acetate) is a colorless to straw-colored liquid. It has an odor like pine needles. It is not very soluble in water. Isobornyl acetate (izobornil asetat, isobornyl acetate) is a natural component in many plants. USE: Isobornyl acetate (izobornil asetat, isobornyl acetate) is an important commercial chemical. It is used in perfuming soaps, air fresheners and in making camphor. It is also used as a flavoring ingredient. EXPOSURE: Workers that use Isobornyl acetate (izobornil asetat, isobornyl acetate) may breathe in vapors or have direct skin contact. The general population may be exposed by vapors, dermal contact and consumption of food flavored with Isobornyl acetate (izobornil asetat, isobornyl acetate). If Isobornyl acetate (izobornil asetat, isobornyl acetate) is released to the environment, it will be broken down in air. It is not expected to be broken down by sunlight. It will move into air from moist soil and water surfaces. It is expected to move through soil. It will be broken down by microorganisms, and is expected to build up in fish. RISK: Allergic skin reactions were not observed in volunteers following direct skin exposure. Other data on the potential for Isobornyl acetate (izobornil asetat, isobornyl acetate) to produce toxic effects in humans were not available. Isobornyl acetate (izobornil asetat, isobornyl acetate) is a mild skin irritant in laboratory animals. Kidney and liver damage and changes in kidney function were reported in laboratory animals following repeated exposure to moderate-to-high oral doses of Isobornyl acetate (izobornil asetat, isobornyl acetate) over time. No effects were reported at low doses. No evidence of infertility, abortion, or birth defects was reported in laboratory animals exposed to high oral doses of Isobornyl acetate (izobornil asetat, isobornyl acetate) before and during pregancy. Data on the potential for Isobornyl acetate (izobornil asetat, isobornyl acetate) to cause cancer in laboratory animals were not available. The potential for Isobornyl acetate (izobornil asetat, isobornyl acetate) to cause cancer in humans has not been assessed by the U.S. EPA IRIS program, the International Agency for Research on Cancer, or the U.S. National Toxicology Program 14th Report on Carcinogens. For Isobornyl acetate (izobornil asetat, isobornyl acetate) (USEPA/OPP Pesticide Code: 128875) there are 0 labels match. /SRP: Not registered for current use in the USA, but approved pesticide uses may change periodically and so federal, state and local authorities must be consulted for currently approved uses. Isobornyl acetate (izobornil asetat, isobornyl acetate) is used in large amounts for perfuming soap, bath products, and air fresheners. However, the major use of Isobornyl acetate (izobornil asetat, isobornyl acetate) is as an intermediate in the production of camphor. Isobornyl acetate (izobornil asetat, isobornyl acetate) is prepared from camphene and acetic acid in the presence of acidic catalysts (e.g., sulfuric acid), or on a styrene-divinylbenzene acid ion-exchanger. Residues of Isobornyl acetate (izobornil asetat, isobornyl acetate) are exempted from the requirement of a tolerance when used in accordance with good agricultural practice as inert (or occasionally active) ingredients in pesticide formulations applied to growing crops only. IDENTIFICATION AND USE: Isobornyl acetate (izobornil asetat, isobornyl acetate) is used in soaps, detergents, creams and lotions and perfumes. HUMAN STUDIES: A maximization test was carried out on 25 volunteers. The material was tested at a concentration of 10% and produced no sensitization reactions. ANIMAL STUDIES: Isobornyl acetate (izobornil asetat, isobornyl acetate) applied full strength to intact or abraded rabbit skin for 24 hr under occlusion was mildly irritating. Isobornyl acetate (izobornil asetat, isobornyl acetate) was administered daily to rats in doses of 0, 15, 90 or 270 mg/kg bw for 13 wk. Male rats had signs of nephrotoxicity at 90 mg/kg and 270 mg/kg/day, as well as signs of hepatotoxicity at 270 mg/kg. Isobornyl acetate (izobornil asetat, isobornyl acetate) was investigated in a 1-generation reproduction study in rats and it did not produce developmental toxicity. Increased incidences of excess salivation occurred in parent generation male and female rats at 100 and/or 300 mg/kg/d throughout the dosage period, and low incidences of urine-stained abdominal fur were seen in females at 300 mg/kg/d during the gestation period. Isobornyl acetate (izobornil asetat, isobornyl acetate)'s production and use in toilet waters, bath preparations, antiseptics, soaps, making synthetic camphor and as a flavoring agent may result in its release to the environment through various waste streams. Its use in compounding needle odors and theater sprays will result in its direct release to the environment. Isobornyl acetate (izobornil asetat, isobornyl acetate) is reported in a wide variety of herbs and other plants. If released to air, an estimated vapor pressure of 0.11 mm Hg at 25 °C indicates Isobornyl acetate (izobornil asetat, isobornyl acetate) will exist solely as a vapor in the atmosphere. Vapor-phase Isobornyl acetate (izobornil asetat, isobornyl acetate) 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 50 hrs. Isobornyl acetate (izobornil asetat, isobornyl acetate) does not contain chromophores that absorb at wavelengths >290 nm and, therefore, is not expected to be susceptible to direct photolysis by sunlight. If released to soil, Isobornyl acetate (izobornil asetat, isobornyl acetate) is expected to have moderate mobility based upon an estimated Koc of 420. Volatilization from moist soil surfaces is expected to be an important fate process based upon an estimated Henry's Law constant of 9.5X10-5 atm-cu m/mole. Isobornyl acetate (izobornil asetat, isobornyl acetate) has an estimated vapor pressure of 0.11 mm Hg and exists as a liquid under environmental conditions; therefore, Isobornyl acetate (izobornil asetat, isobornyl acetate) may volatilize from dry soil. Using the OECD Biodegradability test, isoborneol acetate was biodegraded in 10 days, suggesting that biodegradation is an important environment fate process in soil or water. If released into water, Isobornyl acetate (izobornil asetat, isobornyl acetate) is 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 estimated Henry's Law constant. Estimated volatilization half-lives for a model river and model lake are 17 hrs and 9.5 days, respectively. An estimated BCF of 320 suggests the potential for bioconcentration in aquatic organisms is moderate. Hydrolysis is not expected to be an important environmental fate process as indicated by estimated base-catalyzed second-order half-lives of 2.3 yrs and 84 days at pH values of 7 and 8, respectively. Occupational exposure to Isobornyl acetate (izobornil asetat, isobornyl acetate) may occur through inhalation and dermal contact with this compound at workplaces where Isobornyl acetate (izobornil asetat, isobornyl acetate) is produced or used. Monitoring data indicate that the general population may be exposed to Isobornyl acetate (izobornil asetat, isobornyl acetate) via inhalation of ambient air, ingestion of food, and dermal contact with consumer products containing Isobornyl acetate (izobornil asetat, isobornyl acetate). Isobornyl acetate (izobornil asetat, isobornyl acetate) is reported in a wide variety of herbs and other plants(1). It is a natural emmission from pine and fir trees(2). The compound is reported as occurring in thymus, Parmesan cheese, dill herb, Ocimum basilicum, rosemary and custard apple(3). Isobornyl acetate (izobornil asetat, isobornyl acetate)'s production and use in toilet waters, bath preparations, antiseptics, soaps, making synthetic camphor(1) and as a flavoring agent(1,2) may result in its release to the environment through various waste streams. Its use in compounding pine needle odors and theater sprays(1) will result in its direct release to the environment(SRC). TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 420(SRC), determined from a structure estimation method(2), indicates that Isobornyl acetate (izobornil asetat, isobornyl acetate) is expected to have moderate mobility in soil(SRC). Volatilization of Isobornyl acetate (izobornil asetat, isobornyl acetate) from moist soil surfaces is expected to be an important fate process(SRC) given an estimated Henry's Law constant of 9.5X10-5 atm-cu m/mole(SRC), developed using a fragment constant estimation method(2). Isobornyl acetate (izobornil asetat, isobornyl acetate) has an estimated vapor pressure of 0.11 mm Hg(2) and exists as a liquid under environmental conditions; therefore, Isobornyl acetate (izobornil asetat, isobornyl acetate) may volatilize from dry soil. Using the OECD Biodegradability test, isoborneol acetate was biodegraded in 10 days(3), suggesting that biodegradation is an important environment fate process in soil(SRC). ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), Isobornyl acetate (izobornil asetat, isobornyl acetate), which has an estimated vapor pressure of 0.11 mm Hg at 25 °C(SRC), determined from a fragment constant method(2), is expected to exist solely as a vapor in the ambient atmosphere. Vapor-phase Isobornyl acetate (izobornil asetat, isobornyl acetate) is degraded in the atmosphere by reaction with photochemically-produced hydroxyl radicals(SRC); the half-life for this reaction in air is estimated to be 50 hrs(SRC), calculated from its rate constant of 7.7X10-12 cu cm/molecule-sec at 25 °C(SRC) that was derived using a structure estimation method(2). Isobornyl acetate (izobornil asetat, isobornyl acetate) does not contain chromophores that absorb at wavelengths >290 nm(3) and, therefore, is not expected to be susceptible to direct photolysis by sunlight(SRC). AEROBIC: Isobornyl acetate (izobornil asetat, isobornyl acetate) was biodegraded in 10 days in the OECD Ready Biodegradability test. The compound was 29.0 and 99.8% removed in wastewater treat plants under primary gravitational settling and activated sludge treatement process, respectively(1). The rate constant for the vapor-phase reaction of Isobornyl acetate (izobornil asetat, isobornyl acetate) with photochemically-produced hydroxyl radicals has been estimated as 7.7X10-12 cu cm/molecule-sec at 25 °C(SRC) using a structure estimation method(1). This corresponds to an atmospheric half-life of about 50 hours at an atmospheric concentration of 5X10+5 hydroxyl radicals per cu cm(1). A base-catalyzed second-order hydrolysis rate constant of 9.5X10-2 L/mole-sec(SRC) was estimated using a structure estimation method(1); this corresponds to half-lives of 2.3 yrs and 84 days at pH values of 7 and 8, respectively(1). Isobornyl acetate (izobornil asetat, isobornyl acetate) does not contain chromophores that absorb at wavelengths >290 nm(2) and, therefore, is not expected to be susceptible to direct photolysis by sunlight(SRC). An estimated BCF of 320 was calculated in fish for Isobornyl acetate (izobornil asetat, isobornyl acetate)(SRC), using a log Kow of 4.30(1) and a regression-derived equation(2). According to a classification scheme(3), this BCF suggests the potential for bioconcentration in aquatic organisms is high(SRC). Using a structure estimation method based on molecular connectivity indices(1), the Koc of Isobornyl acetate (izobornil asetat, isobornyl acetate) can be estimated to be 420(SRC). According to a classification scheme(2), this estimated Koc value suggests that Isobornyl acetate (izobornil asetat, isobornyl acetate) is expected to moderate mobility in soil(SRC). Isobornyl acetate (izobornil asetat, isobornyl acetate) readily hydrolyzes (within hours) to isobornyl alcohol during the first step of its biochemical pathway. The alcohol will become conjugated with glucoronic acid and be excreted in the urine (expected within hours to days). IDENTIFICATION: Isobornyl acetate (izobornil asetat, isobornyl acetate) is a colorless to straw-colored liquid. It has an odor like pine needles. It is not very soluble in water. Isobornyl acetate (izobornil asetat, isobornyl acetate) is a natural component in many plants. USE: Isobornyl acetate (izobornil asetat, isobornyl acetate) is an important commercial chemical. It is used in perfuming soaps, air fresheners and in making camphor. It is also used as a flavoring ingredient. EXPOSURE: Workers that use Isobornyl acetate (izobornil asetat, isobornyl acetate) may breathe in vapors or have direct skin contact. The general population may be exposed by vapors, dermal contact and consumption of food flavored with Isobornyl acetate (izobornil asetat, isobornyl acetate). If Isobornyl acetate (izobornil asetat, isobornyl acetate) is released to the environment, it will be broken down in air. It is not expected to be broken down by sunlight. It will move into air from moist soil and water surfaces. It is expected to move through soil. It will be broken down by microorganisms, and is expected to build up in fish. RISK: Allergic skin reactions were not observed in volunteers following direct skin exposure. Other data on the potential for Isobornyl acetate (izobornil asetat, isobornyl acetate) to produce toxic effects in humans were not available. Isobornyl acetate (izobornil asetat, isobornyl acetate) is a mild skin irritant in laboratory animals. Kidney and liver damage and changes in kidney function were reported in laboratory animals following repeated exposure to moderate-to-high oral doses of Isobornyl acetate (izobornil asetat, isobornyl acetate) over time. No effects were reported at low doses. No evidence of infertility, abortion, or birth defects was reported in laboratory animals exposed to high oral doses of Isobornyl acetate (izobornil asetat, isobornyl acetate) before and during pregancy. Data on the potential for Isobornyl acetate (izobornil asetat, isobornyl acetate) to cause cancer in laboratory animals were not available. The potential for Isobornyl acetate (izobornil asetat, isobornyl acetate) to cause cancer in humans has not been assessed by the U.S. EPA IRIS program, the International Agency for Research on Cancer, or the U.S. National Toxicology Program 14th Report on Carcinogens. For Isobornyl acetate (izobornil asetat, isobornyl acetate) (USEPA/OPP Pesticide Code: 128875) there are 0 labels match. /SRP: Not registered for current use in the USA, but approved pesticide uses may change periodically and so federal, state and local authorities must be consulted for currently approved uses. Isobornyl acetate (izobornil asetat, isobornyl acetate) is used in large amounts for perfuming soap, bath products, and air fresheners. However, the major use of Isobornyl acetate (izobornil asetat, isobornyl acetate) is as an intermediate in the production of camphor. The Henry's Law constant for Isobornyl acetate (izobornil asetat, isobornyl acetate) is estimated as 9.5X10-5 atm-cu m/mole(SRC) developed using a fragment constant estimation method(1). This Henry's Law constant indicates that Isobornyl acetate (izobornil asetat, isobornyl acetate) 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 17 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 9.5 days(SRC). Isobornyl acetate (izobornil asetat, isobornyl acetate)'s Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC).Isobornyl acetate (izobornil asetat, isobornyl acetate) has an estimated vapor pressure of 0.11 mm Hg(SRC), determined from a fragment constant method(13) and exists as a liquid under environmental conditions: therefore, Isobornyl acetate (izobornil asetat, isobornyl acetate) may volatilize from dry soil(SRC). Isobornyl acetate (izobornil asetat, isobornyl acetate) dissipated within one week when added along with 21 other fragrance materials to a Georgetown, DE anaerobically digested municipal sludge and applied to four soils (sandy agricultural loam, silty midwestern agrigultural loam, high organic carbon soil, and a highly weathered oxide-rich soil)(3). Isobornyl acetate (izobornil asetat, isobornyl acetate) was reported at an average concentration of 5,130 ng/L in municipal wastewater influent and an average concentration of 24 ng/L in treated effluent, following a 3-day period in September 1997 at an activated sludge treatment plant in Loveland, OH. Influent and effluent average concentrations of 2,830 and 58 ng/L, respectively, when subjected to trickling filter wastewater treatment(1). Isobornyl acetate (izobornil asetat, isobornyl acetate) was present in frankfurters in both 30% and 5% fat content samples analyzed(1). It was tested for but not detected in headspace volatiles from frankfurters(2). Isobornyl acetate (izobornil asetat, isobornyl acetate) was detected not qunatified in emissions from pine-scented plug-in air fresheners(1). Occupational exposure to Isobornyl acetate (izobornil asetat, isobornyl acetate) may occur through inhalation and dermal contact with this compound at workplaces where Isobornyl acetate (izobornil asetat, isobornyl acetate) is produced or used. Monitoring data indicate that the general population may be exposed to Isobornyl acetate (izobornil asetat, isobornyl acetate) via inhalation of ambient air, ingestion of food, and dermal contact with consumer products containing Isobornyl acetate (izobornil asetat, isobornyl acetate). Isobornyl acetate (izobornil asetat, isobornyl acetate) is conifer herbal camphoraceous coniferous earthy pineneedle pine balsamic camphor aromatherapy lilac mens fougere needle woody lavender spruce citrus nutmeg ginger meat fruit-flavour. Isobornyl acetate (izobornil asetat, isobornyl acetate) (an isomer of bornyl acetate) is a component of many essential oils, which was observed to be inhibitory to microorganisms. It was also shown to have sedative effect on mice after inhalation. Isobornyl acetate (izobornil asetat, isobornyl acetate) is mainly used in cosmetics as a flavor and fragrance agent. Isobornyl acetate (izobornil asetat, isobornyl acetate) (IBCH, Sandenol) is an organic compound used primarily as a fragrance because of its aroma which is similar to sandalwood oil. Its chemical structure is closely related to that of both α-Santalol and β-Santalol,[3] which are the primary constituents of sandalwood oil. Sandalwood trees are endangered due to overharvesting,[4] leading to a high cost for the natural oil. IBCH is therefore produced as an economical alternative to the natural product. Applications of Isobornyl acetate (izobornil asetat, isobornyl acetate) Isobornyl acetate (izobornil asetat, isobornyl acetate) is one of the most important chemicals used in the perfumery industry. It is used in toiletries and soaps as a flavoring agent and antiseptics. One of main applications is as an intermediate to produce camphor. Solubility of Isobornyl acetate (izobornil asetat, isobornyl acetate) Not miscible or difficult to mix with water. Isobornyl acetate (izobornil asetat, isobornyl acetate) is a kind of acetate ester. It can be manufactured through the esterification between acetate and camphene. It is a kind of flavoring agent with fragrance. It can be used as the intermediate needed for producing medical synthetic camphor.

1-Hydroxymethylpropane; Isopropylcarbinol; 2-Methyl-1-Propanol; Isobutyl alcohol; Isopropylcarbinol; Fermentation butyl alcohol; 1-Hydroxymethylpropane; 2-Methylpropanol; 2-Methylpropan-1-ol; 2-Methylpropanol-1; 2-Methylpropyl alcohol; Butanol-iso; Alcool isobutylique; Isobutylalkohol; cas no:78-83-1

HYPOPHOSPHORUS ACID; Phosphinic Acid; Acide phosphinique; Phosphinsäure; ácido fosfínico (Spanish); cas no: 6303-21-5

SynonymsE132;Was35;l-blau2;murabba;CI 73015;1311blue;Greell S;12070blue;acidbluew;c.i.75781 CAS No.860-22-0

ISOBUTYL PALMITATE, N° CAS : 110-34-9, Nom INCI : ISOBUTYL PALMITATE, Nom chimique : Isobutyl palmitate, N° EINECS/ELINCS : 203-758-2. Ses fonctions (INCI). Emollient : Adoucit et assouplit la peau.Agent d'entretien de la peau : Maintient la peau en bon état

cas no 110-19-0 Acetic acid, 2-methylpropyl ester; Acetic acid, isobutyl ester; beta-Methylpropyl ethanoate; 2-Methyl-1-propyl acetate; 2-Methylpropyl acetate; Acetate d'isobutyle (French); Isobutyl acetate; Isobutylester kyseliny octove (Czech);

1- amino-2-methyl propane 1- amino-2-methylpropane monoiso butyl amine iso butylamine 2- methyl propanamine 2- methyl propyl amine 2- methyl-1-aminopropane 2- methyl-1-propanamine 2- methyl-1-propylamine 3- methyl-2-propyl amine 2- methylpropan-1-amine 2- methylpropanamine 2- methylpropylamine 1- propanamine, 2-methyl- iso propylmethylamine valamineCAS Number: 78-81-9

Methylpentanol; MIBC; sec-Hexyl Alcohol; MAOH; 2-Methyl-4-pentanol; 4-methyl-2-pentanol; 4-Methylpentan-2-ol; Isobutylmethyl Carbinol; Methyl-2-pentanol; Methylamyl alcohol; Isobutylmethyl Methanol; cas no: 108-11-2

as no 543-27-1 Isobutyl chlorocarbonate; Isobutyl chloroformate; 2-Methylpropyl carbonochloridate; 2-Methylpropyl chloroformate; Chlorocarbonic acid isobutyl ester; Carbonochloridic acid 2-methylpropyl ester; Chloroformic acid isobutyl ester;

cas no 13361-31-4 Cyanoacetic Acid Isobutyl Ester; Isobutyl Cyanoethanoate; 2-Methylpropyl cyanoacetate; Acetic acid, cyano-, isobutyl ester;

cas no 97-85-8 2-Methylpropyl isobutyrate; Isobutyl isobutyrate; IBIB; 2-Methyl-1-propyl 2-methylpropanoate; 2-Methylpropyl 2-methylpropanoate; 2-Methylpropyl 2-methylpropionate; 2-Methylpropyl isobutyrate; Isobutyl 2-methylpropanoate; Isobutyl isobutanoate; Isobutylester kyseliny isomaselne; Isobutyric acid isobutyl ester; 2-mMthylpropanoic acid 2-methylpropyl ester;

cas no 97-86-9 2-methyl-2-propenoic acid, 2-methylpropyl ester; iBMA; 2-methylpropyl methacrylate; 2-methylpropyl 2-methylpropenoate; 2-Propenoic acid, 2-methyl-, 2-methylpropyl ester; Isobutylester kyseliny methakrylove; Methacrylate d'isobutyle;

ferricchloride iron (III) chloride iron trichloride iron(3+) trichloride iron(III) chloride trichloroiron CAS Number:7705-08-0

ISOBUTYL SALICYLATE, N° CAS : 87-19-4, Nom INCI : ISOBUTYL SALICYLATE Nom chimique : 2-Methylpropyl 2-Hydroxybenzoate N° EINECS/ELINCS : 201-729-9 Ses fonctions (INCI) Agent parfumant : Utilisé pour le parfum et les matières premières aromatiques

ISOBUTYL STEARATE, N° CAS : 646-13-9, Nom INCI : ISOBUTYL STEARATE, Nom chimique : Isobutyl stearate, N° EINECS/ELINCS : 211-466-1. Ses fonctions (INCI) : Emollient : Adoucit et assouplit la peau, Agent d'entretien de la peau : Maintient la peau en bon état

ISOBUTYLPARABEN, N° CAS : 4247-02-3, Ses fonctions (INCI) Antimicrobien : Aide à ralentir la croissance de micro-organismes sur la peau et s'oppose au développement des microbes

Isobutyl stearate is an ester made of combination of isobutyl alcohol and stearic acid.
Isobutyl stearate are stearate esters that are oily liquids or waxy solids.
Isobutyl stearate has molecular weight of 340.592 g/mol.

CAS Number: 646-13-9
EC Number: 211-466-1
Molecular Formula: C22H44O2
Molecular Weight: 340.58

Isobutyl stearate is a natural product found in Aristolochia baetica, Aristolochia fontanesii, and Aristolochia paucinervis with data available.

Isobutyl stearate are stearate esters that are oily liquids or waxy solids.
Isobutyl stearate has molecular weight of 340.592 g/mol.

Isobutyl stearate is an ester made of combination of isobutyl alcohol and stearic acid.
Stearic acid is found in animal and vegetable fats.
Low viscosity and oily nature of stearate esters helps in the formation of non-greasy hydrophobic film when applied to lips or skin.

Isobutyl stearate esters are majorly used in cosmetics and personal care products.
Stearate esters primarily act as lubricants on the skin surface due to their oily or waxy property.

This gives skin a soft and smoothening appearance.
Isobutyl stearate content when applied on skin in form of skin cosmetics forms a thin coating.

Thus, isobutyl stearate acts as a skin conditioning agent.
Isobutyl stearate is used during the formulation of eye makeup, lipstick, and skin makeup.

Isobutyl stearate is used in other applications in metalworking and industrial segments due to Isobutyl stearate lubricant nature.
Rise in demand for personal care products and bio-lubricants in the metal working industry is one of the key drivers of the isobutyl stearate market.

Based on application, the isobutyl stearate market can be segmented into personal care & cosmetics, metal working, and industrial.
Personal care & cosmetics contributed significant share of the isobutyl stearate market in 2016.

Isobutyl stearate is likely to remain the dominant segment during the forecast period.
Rise in usage of bio-esters in formulation of personal care and cosmetics products and increase in usage of personal care & cosmetics products across the globe are the prominent factors expected to drive the isobutyl stearate market between 2017 and 2025.

The stearate esters (Butyl Stearate, Cetyl Stearate, Isocetyl Stearate, Isopropyl Stearate, Myristyl Stearate, Ethylhexyl Stearate, Isobutyl Stearate) are oily liquids or waxy solids.
Ethylhexyl Stearate may also be called Octyl Stearate.
In cosmetics and personal care products, stearate esters are used most frequently in the formulation of eye makeup, skin makeup, lipstick and skin care products.

Stearate esters act primarily as lubricants on the skin’s surface, which gives the skin a soft and smooth appearance.
Butyl Stearate also decreases the thickness of lipsticks, thereby lessening the drag on lips, and imparts water repelling characteristics to nail polishes.

Butyl Stearate and Isopropyl Stearate dry to form a thin coating on the skin.
Isocetyl Stearate can also be used to dissolve other substances, usually liquids.

Isobutyl stearates are stearate esters that are oily liquids or waxy solids.
Isobutyl stearate is known with many chemical names such as isobutyl ester, 2-methylpropyl ester, octadecanoic acid, and Kessco IBS.

Isobutyl stearate has molecular weight of 340.592 g/mol.
Isobutyl stearate is an ester made of combination of isobutyl alcohol and stearic acid.

Stearic acid is found in animal and vegetable fats.
Low viscosity and oily nature of stearate esters helps in the formation of non-greasy hydrophobic film when applied to lips or skin.

Isobutyl stearate esters are majorly used in cosmetics and personal care products.
Stearate esters primarily act as lubricants on the skin surface due to their oily or waxy property.

This gives skin a soft and smoothening appearance. Isobutyl stearate content when applied on skin in form of skin cosmetics forms a thin coating.
Thus, isobutyl stearate acts as a skin conditioning agent.

Isobutyl stearate is used during the formulation of eye makeup, lipstick, and skin makeup.
Isobutyl stearate is used in other applications in metalworking and industrial segments due to Isobutyl stearate lubricant nature.

Rise in demand for personal care products and bio-lubricants in the metal working industry is one of the key drivers of the isobutyl stearate market.
However, slow growth of metalworking fluid market which is one of the key applications of IBS and confined production of IBS in limited countries in Europe are the major restraints for the market.

Covid-19 Impact Analysis:
The coronavirus's unfavorable global effects are already evident, and they will have a big impact on the Isobutyl stearate in 2020.
The World Health Organization has declared a public health emergency after the COVID-19 virus outbreak in December 2019.

The disease has spread to over 100 nations and resulted in massive deaths all across the world.
Exports & Imports, global manufacturing, tourism, and financial sectors have all been heavily damaged.

The downward pressure on the global economy, which had previously shown signs of improvement, has escalated once more.
The outbreak of the virus has added danger factors to the international economy's already sluggish development.

Many international groups have stated that the global economy is experiencing Isobutyl stearate most difficult moment since the financial crisis.
The lockdown has resulted in hampering the imports and exports of various goods.
Also, the uncertainty created in the market in the consumers’ buying pattern has resulted in hampering of the Isobutyl stearate.

Top Impacting Factors:
The global isobutyl stearate market is dependent on the supply & demand of end-use industries, and the raw materials.
Stearic acid is the main raw material, which is obtained from vegetable and animal fats, any fluctuations in the supply of steric acid have a direct effect on the isobutyl stearate manufacturers.
Also, the substitutes for isobutyl stearate are butyl stearate itself, which can also be used for the same application wherein isobutyl stearate is used and thus restricts the market to some extent.

The personal care and cosmetic manufacturers are the chief customers for isobutyl stearate chemical and their growth basically drives the isobutyl stearate consumption rate.
Further, the factors which indirectly supports the cosmetic & personal care manufacturers’ growth is the rising disposable income of individuals, urbanization & development of megacities, demographic trends, penetration of premiumization.

Market trends:
The increasing consumption in metalworking fluids and personal care industry drives the global Isobutyl stearate market.
Isobutyl stearate (IBS) is an ester which is primarily used in metalworking, personal care and other industrial activities.

Isobutyl stearate is a stearate ester which is available in both oily liquid and waxy solid forms.
Isobutyl stearate due to its less toxicity is widely preferred as an ingredient in personal care products.
Similarly, the use of esters in metal lubricating application has increased over the years due to Isobutyl stearate excellent lubricating properties.

Isobutyl stearate improves the lubricity of different metals like copper, steel and aluminum.
The demand for isobutyl stearate is expected to grow in the coming years, due to Isobutyl stearate increasing consumption in metalworking fluids and personal care industry.

Stearate esters have excellent lubricating properties and therefore preferred as metalworking lubricants.
These esters have a low viscosity and are also used in personal care products.

Rising demand for the market in the growing economies is a key driver for the market.
Continuous increase in online beauty spending, expansion of social networks, consumers' interest in new, different, and premium products, acceleration of urbanization worldwide, and growth of the upper-middle classes all over the world and especially in Asia, where consumers are both knowledgeable and enthusiastic about this segment, are some of the major factors that contribute to the steady growth of the cosmetics and personal care market.

Rising demand in various end-use industries like pharmaceuticals and textile is also expected to boost the market growth.
Isobutyl stearate is also used in topical pharmaceuticals.

The Asia-Pacific pharmaceutical market is the third-largest pharmaceutical market in the world after North America and Europe, owing to the size of the population, especially the older population, GDP per capita, health expenditures, and regulatory systems, among others.
In textile manufacturing, countries such as Vietnam, Bangladesh, China, India and Hong Kong stand out among the top 10 global manufacturers, hence, indicating regular demand for isobutyl stearate to be used as a lubricant for textile processing.

Uses of Isobutyl stearate:
Isobutyl stearate is used in waterproof coatings, polishes, face creams, rouges, ointments, soaps, inks, and lubricants.
Isobutyl stearate is also used in rubber manufacturing and in dye solutions.

Isobutyl stearate is used in waterproof coatings, polishes, face creams, rouges, ointments, soaps, rubber mfr, dye soln, inks, lubricants
Isobutyl stearate is used in cosmetics, inks, coatings, polishes

Construction and building materials:
Materials used for construction (e.g. flooring, tile, sinks, bathtubs, mirrors, wall materials/drywall, wall-to-wall carpets, insulation, playground surfaces).

Personal care:
Moisturizers, lotions, and creams for treating the face (excluding eye-specific products) such as emollient, flavouring, skin conditioning.

Industry Uses:
Finishing agents
Lubricants and lubricant additives

Consumer Uses:
Lubricants and lubricant additives

General Manufacturing Information of Isobutyl stearate:

Industry Processing Sectors:
Fabricated Metal Product Manufacturing
Textiles, apparel, and leather manufacturing

Stability and Reactivity of Isobutyl stearate:

Chemical Stability:
Stable under normal temperatures and pressures.

Hazardous Polymerization:
Will not occur under normal conditions.

Keep Away From:
Sources of ignition.

Handling and Storage
Avoid contact with skin, eyes, and clothing.
Use with adequate ventilation.

Avoid breathing fumes.
Use normal personal hygiene and housekeeping.
Store in a cool dry area away from other incompatible

First Aid Measures of Isobutyl stearate:

Skin:
Immediately wash skin with soap and water for at least 15 minutes.

Eyes:
Immediately flush with plenty of water for at least 15 mintues, holding eye lids apart.

Inhalation:
Remove to the fresh air.
If not breathing give artificial respiration.
If breathing is difficult, give oxygen.

Ingestion:
Wash out mouth with water.

On All of the Above:
Consult a physician if symptoms persist.

Fire Fighting Measures of Isobutyl stearate:
Flash Point: >170C
Flammable Limits: N/A

Extinguishing Media:
Use media that is appropriate to treat surrounding fire.
Water or foam may cause frothing.

Special Fire Fighting Procedures:
Use fire fighting procedure that is appropriate to treat surrounding fire.
All firefighters should use selfcontained breathing apparatus and full fire-fighting turn-out gear.

Auto Ignition Temperature:
N/A

Accidental Release Measures of Isobutyl stearate:
Isolate hazard area and deny entry to unnecessary or unprotected personnel.
Contain Spilled liquid with sand or earth.

Place in a disposal Container.
Avoid runnoff into storm sewers and ditches which lead to waterways.

Safety of Isobutyl stearate:

Storage class:
10 - 13 Other liquids and solids

WGK:
WGK 1 slightly hazardous to water

Identifiers of Isobutyl stearate:
CAS number: 646-13-9
EC number: 211-466-1
Hill Formula: C₂₂H₄₄O₂
Molar Mass: 340.58 g/mol
HS Code: 2915 70 50

CAS Number: 646-13-9
Chem/IUPAC Name: Isobutyl stearate
EINECS/ELINCS No: 211-466-1
COSING REF No: 34606

EC / List no.: 211-466-1
CAS no.: 646-13-9
Mol. formula: C22H44O2

Synonym(s): Isobutyl stearate
Empirical Formula (Hill Notation): C22H44O2
CAS Number: 646-13-9
Molecular Weight: 340.58
EC Index Number: 211-466-1

Properties of Isobutyl stearate:
Density: 0.85 g/cm3 (20 °C)
Melting Point: 28.9 °C

Quality Level: 200
Form: solid
mp: 28.9 °C
Density: 0.85 g/cm3 at 20 °C
Storage temp.: 2-30°C
InChI: 1S/C22H44O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(23)24-20-21(2)3/h21H,4-20H2,1-3H3
InChI key: ORFWYUFLWUWSFM-UHFFFAOYSA-N

Molecular Formula: C22H44O2
Molar Mass: 340.58
Density: 0.85 g/cm3 (20℃)
Melting Point: about 20°
Boling Point: 381.5°C
Flash Point: 187.7°C
Vapor Presure: 5.07E-06mmHg at 25°C
Storage Condition: Store below +30°C.
Refractive Index: 1.4365 (estimate)

Molecular Weight: 340.6
XLogP3-AA: 9.9
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 2
Rotatable Bond Count: 19
Exact Mass: 340.334130642
Monoisotopic Mass: 340.334130642
Topological Polar Surface Area: 26.3 Ų
Heavy Atom Count: 24
Complexity: 261
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 Isobutyl stearate:
Saponification value: 170 - 179
Identity (IR): passes test

Names of Isobutyl stearate:

Regulatory process names:
Isobutyl stearate
isobutyl stearate

IUPAC names:
2-methylpropyl octadecanoate
2-methylpropyl oktadekanoát
isobutyl octadecanoate
ISOBUTYL STEARATE
Isobutyl stearate
isobutyl stearate
octadecanoic acid, 2-methylpropyl
Octadecanoic acid, 2-methylpropyl ester

Other identifiers:
646-13-9

Synonyms of Isobutyl stearate:
ISOBUTYL STEARATE
646-13-9
2-Methylpropyl octadecanoate
Octadecanoic acid, 2-methylpropyl ester
Stearic acid, isobutyl ester
V8DPR6HNX3
Stearic acid isobutyl ester
isobutyl octadecanoate
HSDB 2177
EINECS 211-466-1
UNII-V8DPR6HNX3
BRN 1792857
Uniflex IBYS
Kessco IBS
Stearic acid, 2-methylpropyl ester
Kemester 5415
Octadecanoic acid 2-methylpropyl ester
Emerest 2324
Estol 1476
SCHEMBL33706
3-02-00-01017 (Beilstein Handbook Reference)
Isobutyl stearate, AldrichCPR
ISOBUTYL STEARATE [MI]
DTXSID9027285
ISOBUTYL STEARATE [HSDB]
ISOBUTYL STEARATE [INCI]
STL417837
ZINC95876441
AKOS015901564
FT-0696997
646I139
Q27291666
(2E)-3-(9-ETHYL-9H-CARBAZOL-3-YL)ACRYLICACID
isobutyl octadecanoate
2-methyl propyl octadecanoate
2-methylpropyl octadecanoate
octadecanoic acid 2-methyl propyl ester
octadecanoic acid, 2-methylpropyl ester
stearic acid 2-methyl propyl ester
stearic acid, 2-methylpropyl ester
stearic acid, isobutyl ester
HSDB 2177
BRN 1792857
isobutyl stearate
ISOBUTYL STEARATE
Isobutyl stearate
ISOBUTYLOCTADECANOATE
OCTADECANOICACID,2-METHYL-
Stearic acid, isobutyl ester
2-Methylpropyl octadecanoate
stearic acid, isobutyl ester
Octadecanoic acid isobutyl ester
Stearic acid 2-methylpropyl ester
Stearic acid, 2-methylpropyl ester
Octadecanoic acid, 2-methylpropyl ester
3-02-00-01017
211-466-1
646-13-9
Isobutyl stearate
Isobutylstearat
MFCD00072278
Octadecanoic acid, 2-methylpropyl ester
Stéarate d'isobutyle
2-Methylpropyl octadecanoate
3-02-00-01017
3-02-00-01017
EINECS 211-466-1
Emerest 2324
Estol 1476
isobutyl octadecanoate
iso-Butyl Stearate
Isobutylstearate
Kemester 5415
Kessco IBS
Octadecanoic acid
octadecanoic acid isobutyl ester
stearic acid isobutyl ester
Stearic acid, 2-methylpropyl ester
Stearic acid, isobutyl ester
Uniflex IBYS

DESCRIPTION:

Isobutyl Stearate is an ester of isobutyl alcohol and stearic acid.
Isobutyl stearates are stearate esters that are oily liquids or waxy solids.
Isobutyl stearate is known with many chemical names such as isobutyl ester, 2-methylpropyl ester, octadecanoic acid, and Kessco IBS.


CAS NUMBER: 646-13-9

EC NUMBER: 211-466-1

MOLECULAR FORMULA: C22H44O2

MOLECULAR WEIGHT: 340.58



DESCRIPTION:

Isobutyl stearate has molecular weight of 340.592 g/mol.
Isobutyl Stearate is an ester made of combination of isobutyl alcohol and stearic acid.
Stearic acid is found in animal and vegetable fats.
Low viscosity and oily nature of Isobutyl Stearates helps in the formation of non-greasy hydrophobic film when applied to lips or skin.
Isobutyl Stearate is a versatile compound with various applications across different industries.

Isobutyl Stearate is commonly used as an emollient and thickening agent in cosmetics and personal care products.
Isobutyl Stearate is found in creams, lotions, moisturizers, sunscreens, lipsticks, and other skincare formulations.
Isobutyl Stearate's emollient properties help to soften and moisturize the skin, making it feel smooth and supple.
Isobutyl Stearate is used as a lubricant in metalworking processes and other industrial applications.

Isobutyl Stearate's low volatility and good lubricating properties make it suitable for reducing friction and enhancing the flow of materials.
Isobutyl Stearate is utilized in the formulation of coatings and inks to improve their spreadability, glossiness, and durability.
Isobutyl Stearate aids in the even application of coatings and contributes to the overall quality of the finished product.
In certain plastic and polymer formulations, Isobutyl Stearate acts as a plasticizer.

Isobutyl Stearate helps to increase the flexibility and workability of plastics, making them easier to process and shape.
Isobutyl Stearate finds use in various industrial applications, including the manufacturing of resins, waxes, and adhesives.
Isobutyl Stearate can improve the characteristics of these materials and contribute to their overall performance.
Isobutyl Stearate is occasionally used as a food additive.
Isobutyl Stearate may serve as a flavoring agent and a lubricant in certain food processing applications.

Isobutyl Stearate is an organic chemical compound derived from the esterification of isobutyl alcohol and stearic acid.
Isobutyl Stearate is a clear, colorless, and odorless liquid with various industrial applications.
Isobutyl Stearate is a non-toxic and non-irritating substance, making it suitable for many cosmetic and personal care products.
Isobutyl Stearate is soluble in common organic solvents but slightly insoluble in water.
Isobutyl Stearate is commonly used as an emollient and thickening agent in cosmetics and personal care products.

Isobutyl Stearate helps to improve the texture of creams, lotions, and various skincare products, providing a smooth and luxurious feel on the skin.
Due to its low volatility and good lubricating properties, Isobutyl Stearate finds applications as a lubricant in various industries, particularly in metalworking processes.
Isobutyl Stearate can be used as a plasticizer in certain polymer and plastic formulations to improve flexibility and workability.
Isobutyl Stearate is also used in industrial applications such as in the manufacturing of resins, waxes, and adhesives.

Isobutyl stearate esters are majorly used in cosmetics and personal care products.
Stearate esters primarily act as lubricants on the skin surface due to their oily or waxy property.
In cosmetics and personal care products, Isobutyl Stearates are used most frequently in the formulation of eye makeup, skin makeup, lipstick and skin care products.
Isobutyl Stearates act primarily as lubricants on the skin’s surface, which gives the skin a soft and smooth appearance.
Isobutyl Stearate also decreases the thickness of lipsticks, thereby lessening the drag on lips, and imparts water repelling characteristics to nail polishes.

Isobutyl Stearate dry to form a thin coating on the skin.
Isobutyl Stearate can also be used to dissolve other substances, usually liquids.
Isobutyl stearates are stearate esters that are oily liquids or waxy solids.
Isobutyl stearate is known with many chemical names such as isobutyl ester.
Isobutyl stearate has molecular weight of 340.592 g/mol.

Isobutyl Stearate is an ester made of combination of isobutyl alcohol and stearic acid.
Isobutyl Stearate is found in animal and vegetable fats.
Low viscosity and oily nature of Isobutyl Stearates helps in the formation of non-greasy hydrophobic film when applied to lips or skin.
Isobutyl stearate esters are majorly used in cosmetics and personal care products.
Isobutyl Stearates primarily act as lubricants on the skin surface due to their oily or waxy property.

This gives skin a soft and smoothening appearance.
Isobutyl stearate content when applied on skin in form of skin cosmetics forms a thin coating.
Thus, isobutyl stearate acts as a skin conditioning agent.
Isobutyl Stearate is used during the formulation of eye makeup, lipstick, and skin makeup.
Isobutyl stearate is used in other applications in metalworking and industrial segments due to its lubricant nature.
Isobutyl Stearate is comprised of Isobutyl Stearate, It is an emollient used in nail polish remover, perfume fixative, and hair spray.

Isobutyl stearate a chemical belonging to stearate esters family which is primarily used in the personal care products as a lubricants.
Isobutyl stearate is primarily used into cosmetics and personal care products during the formulation of eye makeup, skin makeup, lipstick and skin care products, apart from these it also finds is its applications into metal working.
This gives skin a soft and smoothening appearance.
Isobutyl stearate content when applied on skin in form of skin cosmetics forms a thin coating.

Thus, isobutyl stearate acts as a skin conditioning agent.
Isobutyl Stearate is used during the formulation of eye makeup, lipstick, and skin makeup.
Isobutyl stearate is used in other applications in metalworking and industrial segments due to its lubricant nature.
Rise in demand for personal care products and bio-lubricants in the metal working industry is one of the key drivers of the isobutyl stearate market.
Isobutyl Stearates act primarily as lubricants on the skin's surface, which gives the skin a soft and smooth appearance.
Isobutyl Stearate dry to form a thin coating on the skin.



USAGE AREAS:

-Personal Care
-Metal Working
-Plastic Processing
-Others
-skin conditioning
-skin conditioning - emollient



USAGE AREAS:

-Used as chemical intermediates, lubricants, mineral oils, cutting oils, laminated oils, etc.
-Used as a base in cold rolling of iron
-Used as a lubricant additive in the field of metal processing
-Isobutyl Stearate can also be used as an additive in inks and coatings to enhance fluidity and abrasion resistance.



APPLICATION:

-Lubricants
-Cosmetics
-Coatings
-Polishes
-Waterproof coatings
-face creams
-rouges
-ointments
-soaps
-rubber manufacture
-dye solutions
-inks



FUNCTION:

-Re-Fatting Agent
-Fixative
-Conditioner
-Emollient



PROPERTIES:

-Quality Level: 200
-form: solid
-mp: 28.9 °C
-density: 0.85 g/cm3 at 20 °C
-storage temp.: 2-30°C
-InChI:1S/C22H44O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(23)24-20-2 (2)3/h21H,4-20H2,1-3H3
-InChI key: ORFWYUFLWUWSFM-UHFFFAOYSA-N



TYPICAL PROPERTIES:

-Appearance: Clear light amber liquid
-Color, Gardner/ASTM: 2/1.0 max
-Density, kg/L: 0.87
-Acidity(mg KOH/g): 2.0 max
-Water,%: 0.1 max
-Iodine value,iodine value: 0.5
-Light ends,%: 0.025 max



SPECIFICATION:

-Molecular Weight: 340.6 g/mol
-XLogP3-AA: 9.9
-Hydrogen Bond Donor Count: 0
-Hydrogen Bond Acceptor Count: 2
-Rotatable Bond Count: 19
-Exact Mass: 340.334130642 g/mol
-Monoisotopic Mass: 340.334130642 g/mol
-Topological Polar Surface Area: 26.3Ų
-Heavy Atom Count: 24
-Complexity: 261
-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 INFORMATION:

-Systematic Name: Octadecanoic acid, 2-methylpropyl ester
-CAS Number: 646-13-9
-Molecular Weight: 340.59
-Molecular Formula: C22H44O2



PRODUCT INFORMATION:

-CAS number: 646-13-9
-EC number: 211-466-1
-Hill Formula: C₂₂H₄₄O₂
-Molar Mass: 340.58 g/mol
-Density: 0.85 g/cm3 (20 °C)
-Melting Point: 28.9 °C
-Saponification value: 170 - 179
-Identity (IR): passes test



CHEMICAL PROPERTIES:

-Melting point: about 20°
-Boiling point: 381.5°C
-density: 0.85 g/cm3 (20℃)
-refractive index: 1.4365 (estimate)
-storage temp.: Store below +30°C.
-Odor: at 100.00?%. mild fatty
-LogP: 9.800 (est)



PHYSICAL PROPERTIES:

-Appearance: colorless waxy oily solid (est)
-Assay: 98.00 to 100.00
-Specific Gravity: 0.85000 to 0.85400 @ 25.00 °C.
-Pounds per Gallon - (est).: 7.073 to 7.106
-Refractive Index: 1.44100 at 25.00 °C.
-Melting Point: 28.90 °C. at 760.00 mm Hg
-Boiling Point: 200.00 °C. at 4.00 mm Hg
-Acid Value: 1.00 max. KOH/g
-Saponification Value: 170.00 to 180.00
-Vapor Pressure: 0.000020 mmHg at 25.00 °C. (est)
-Flash Point: > 212.00 °F. TCC ( > 100.00 °C. )
-logP (o/w): 9.800 (est)



SOLUBILITY:

-alcohol
-fixed oils
-mineral oil
-water, 4.21e-005 mg/L @ 25 °C (est)



PROPERTIES:

-Melting Point: 20°C
-Density: 0.861 g/cm3
-Refractive Index: 1.447



PHYSICAL AND CHEMICAL PROPERTIES:

-Exact Mass: 340.334130642
-Monoisotopic Mass: 340.334130642
-Topological Polar Surface Area: 26.3 Ų
-Physical State: Liquid
-Boiling Point: 381.5 °C
-Melting Point: 20 °C
-Solubility: Very soluble in ether
-Density: 0.85 g/cm³ at 20 °C(lit.)
-SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC(C)C



FUNCTION:

-Emollient: Softens and softens the skin
-Skin conditioning agent: Keeps the skin in good condition



STORAGE:

Storage Store below +30°C.
Keep in a cool, dry, dark location in a tightly sealed container or cylinder.
Keep away from incompatible materials, ignition sources and untrained individuals.
Secure and label area.
Protect containers/cylinders from physical damage.



SYNONYM:

646-13-9
2-Methylpropyl octadecanoate
Octadecanoic acid, 2-methylpropyl ester
Stearic acid, isobutyl ester
isobutyl octadecanoate
HSDB 2177
EINECS 211-466-1
UNII-V8DPR6HNX3
V8DPR6HNX3
Stearic acid isobutyl ester
BRN 1792857
Stearic acid, 2-methylpropyl ester
Octadecanoic acid 2-methylpropyl ester
3-02-00-01017 (Beilstein Handbook Reference)
Uniflex IBYS
Kessco IBS
Kemester 5415
Emerest 2324
Estol 1476
SCHEMBL33706
Isobutyl stearate, AldrichCPR
ISOBUTYL STEARATE [MI]
DTXSID9027285
ISOBUTYL STEARATE [HSDB]
ISOBUTYL STEARATE [INCI]
ORFWYUFLWUWSFM-UHFFFAOYSA-N
STL417837
AKOS015901564
LS-146681
FT-0696997
Q27291666
(2E)-3-(9-ETHYL-9H-CARBAZOL-3-YL)ACRYLICACID
Octadecanoic acid, isobutyl ester (Stearic acid, isobutyl ester; Isobutyl stearate)



IUPAC NAME:

2-methylpropyl octadecanoate
2-methylpropyl oktadekanoát
isobutyl octadecanoate
ISOBUTYL STEARATE
Isobutyl stearate
isobutyl stearate
octadecanoic acid, 2-methylpropyl
Octadecanoic acid, 2-methylpropyl ester

ISOCETYL ALCOHOL, N° CAS : 36311-34-9. Nom INCI : ISOCETYL ALCOHOL, Nom chimique : Isohexadecanol. N° EINECS/ELINCS : 252-964-9. Emollient : Adoucit et assouplit la peau.Agent d'entretien de la peau : Maintient la peau en bon état. Agent de contrôle de la viscosité : Augmente ou diminue la viscosité des cosmétiques

FERRIC SULFATE Iron(III) sulfate Iron persulfate Iron tersulfate Diiron tris(sulphate) Diiron trisulfate Ferric persulfate Ferric tersulfate Iron sesquisulfate Ferric sesquisulfate Iron(3+) sulfate Sulfuric acid, iron(3+) salt (3:2) Coquimbite mineral Iron sulfate (2:3) Iron sulfate (Fe2(SO4)3) Iron(3+) sulfate, (2:3) Ferricsulfate Sulfuric acid, iron(3+) salt Iron-S-hydrate iron(III)sulphate Ferric sulfate (USP) Sulfuric acid,iron salt iron(III) sulfate(VI) CAS: 10028-22-5

2-propenoic acid, (1S,4S)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester; acrylic acid isobornyl ester; 2- propenoic acid, 1,7,7-trimethylbicyclo(2.2.1)hept-2-yl ester, exo- cas no : 5888-33-5

Isoceteth-20 is a polyethylene glycol ether formed by the ethoxylation of iso-cetyl alcohol; with the general formula HO(C2H4O)nC16H33 where n has an average value of 20. It is a nonionic surfactant used as an emulsifier in some personal care products. However, as iso-cetyl alcohol is rare in nature isoceteth-20 does not see widespread use.Polyethylene glycol monoisohexadecyl ether; Polyethylene glycol isocetyl ether. A handy helper ingredient that works as an emulsifier or solubilizer to include oil-loving ingredients (such as fragrance) into water-based products. high HLB non-ionic surfactant that is an outstanding solubilizer and emulsifier. It also exhibits excellent foaming characteristics in comparison with other ethoxylated non-ionic surfactants. The Series of surfactants are polyoxyethylene vegetable-based fatty ethers derived from lauryl, cetyl, stearyl and oleyl alcohols. These materials are naturally derived, mild, and virtually odorless nonionic surfactants, and as a series, offer a diverse set of emulsifying characteristics allowing them to confer unique bodying, spreading and stabilizing properties to emulsions.APPEARANCE Clear colorless liquid DESCRIPTION Mild solubilizer and non-ionic surfactant for use in skin and hair care applications. Excellent performance as O/W emulsifier and co-emulsifier for creams and lotions. Outstanding solubilizing properties for lipophilic ingredients. Provides enhanced foam in shampoos and shower gels FUNCTION Frequently used to solubilize perfumes or other liphophilic ingredients into water. It performs as an outstanding stabilizer and emulsifier. It exhibits excellent foaming characteristics in comparison with other ethoxylated nonionic surfactants and unlike ester-type nonionic surfactants. SYNONYMS BRIJ IC20-70-LQ-(AP); Arlasolve 200 L [Isoceteth-20]; Isoceteth-20 Liquid; Uniceth-IC20LUniceth-IC20L; Polyethylene glycol monoisohexadecyl ether; Polyethylene glycol isocetyl ether STORAGE Store in a cool, dry area away from heat, sparks, flame, or smoking. Avoid extreme heat and ignition sources. Store away from oxidizers.

ISOCETYL BEHENATE, N° CAS : 94247-28-6. Nom INCI : ISOCETYL BEHENATE. Nom chimique : Isohexadecyl docosanoate. N° EINECS/ELINCS : 304-205-9. Ses fonctions (INCI). Emollient : Adoucit et assouplit la peau, Agent d'entretien de la peau : Maintient la peau en bon état

ISOCETYL MYRISTATE, N° CAS : 83708-66-1, Nom INCI : ISOCETYL MYRISTATE, Nom chimique : Tetradecanoic acid, isohexadecy ester.Ses fonctions (INCI) : Emollient : Adoucit et assouplit la peau. Agent d'entretien de la peau : Maintient la peau en bon état

ISODECYL ISONONANOATE, N° CAS : 59231-35-5 / 41395-89-5, Nom INCI : ISODECYL ISONONANOATE, Nom chimique : Isodecyl 3,5,5-trimethylhexanoate, N° EINECS/ELINCS : 261-674-1, 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

ISOCETYL PALMITATE (İzosetil Palmitat) IUPAC Name 14-methylpentadecyl hexadecanoate ISOCETYL PALMITATE (İzosetil Palmitat) InChI InChI=1S/C32H64O2/c1-4-5-6-7-8-9-10-11-14-17-20-23-26-29-32(33)34-30-27-24-21-18-15-12-13-16-19-22-25-28-31(2)3/h31H,4-30H2,1-3H3 ISOCETYL PALMITATE (İzosetil Palmitat) InChI Key OUZOBPPZPCBJAR-UHFFFAOYSA-N ISOCETYL PALMITATE (İzosetil Palmitat) Canonical SMILES CCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCC(C)C ISOCETYL PALMITATE (İzosetil Palmitat) Molecular Formula C32H64O2 ISOCETYL PALMITATE (İzosetil Palmitat) CAS 127770-27-8 ISOCETYL PALMITATE (İzosetil Palmitat) UNII 355356620Z ISOCETYL PALMITATE (İzosetil Palmitat) DSSTox Substance ID DTXSID2074584 ISOCETYL PALMITATE (İzosetil Palmitat) Related Compounds Similar Compounds 5,069 Records ISOCETYL PALMITATE (İzosetil Palmitat) Related Substances Same 18 Records ISOCETYL PALMITATE (İzosetil Palmitat) Use Classification Cosmetics -> Emollient; Skin conditioning ISOCETYL PALMITATE (İzosetil Palmitat) Molecular Weight 480.8 g/mol ISOCETYL PALMITATE (İzosetil Palmitat) XLogP3-AA 14.9 ISOCETYL PALMITATE (İzosetil Palmitat) Hydrogen Bond Donor Count 0 ISOCETYL PALMITATE (İzosetil Palmitat) Hydrogen Bond Acceptor Count 2 ISOCETYL PALMITATE (İzosetil Palmitat) Rotatable Bond Count 29 ISOCETYL PALMITATE (İzosetil Palmitat) Exact Mass 480.490631 g/mol ISOCETYL PALMITATE (İzosetil Palmitat) Monoisotopic Mass 480.490631 g/mol ISOCETYL PALMITATE (İzosetil Palmitat) Topological Polar Surface Area 26.3 Ų ISOCETYL PALMITATE (İzosetil Palmitat) Heavy Atom Count 34 ISOCETYL PALMITATE (İzosetil Palmitat) Formal Charge 0 ISOCETYL PALMITATE (İzosetil Palmitat) Complexity 391 ISOCETYL PALMITATE (İzosetil Palmitat) Isotope Atom Count 0 ISOCETYL PALMITATE (İzosetil Palmitat) Defined Atom Stereocenter Count 0 ISOCETYL PALMITATE (İzosetil Palmitat) Undefined Atom Stereocenter Count 0 ISOCETYL PALMITATE (İzosetil Palmitat) Defined Bond Stereocenter Count 0 ISOCETYL PALMITATE (İzosetil Palmitat) Undefined Bond Stereocenter Count 0 ISOCETYL PALMITATE (İzosetil Palmitat) Covalently-Bonded Unit Count 1 ISOCETYL PALMITATE (İzosetil Palmitat) Compound Is Canonicalized Yes ISOCETYL PALMITATE Properties Palmitic acid, or ISOCETYL PALMITATE (İzosetil Palmitat) in IUPAC nomenclature, is the most common saturated fatty acid found in animals, plants and microorganisms.Its chemical formula is CH3(CH2)14COOH, and its C:D is 16:0. As its name indicates, it is a major component of the oil from the fruit of oil palms (palm oil). Palmitic acid can also be found in meats, cheeses, butter, and other dairy products. Palmitates are the salts and esters of ISOCETYL PALMITATE (İzosetil Palmitat). The palmitate anion is the observed form of ISOCETYL PALMITATE (İzosetil Palmitat) at physiologic pH (7.4).Aluminium salts of ISOCETYL PALMITATE (İzosetil Palmitat) and naphthenic acid were combined during World War II to produce napalm. The word "napalm" is derived from the words naphthenic acid and ISOCETYL PALMITATE (İzosetil Palmitat).Palmitic acid was discovered by Edmond Frémy in 1840, in saponified palm oil.This remains the primary industrial route for its production, with the triglycerides (fats) in palm oil being hydrolysed by high temperature water (above 200 °C or 390 °F), and the resulting mixture fractionally distilled to give the pure product.Palmitic acid is naturally produced by a wide range of other plants and organisms, typically at low levels. It is naturally present in butter, cheese, milk, and meat, as well as cocoa butter, soybean oil, and sunflower oil. Karukas contain 44.90% ISOCETYL PALMITATE (İzosetil Palmitat).The cetyl ester of ISOCETYL PALMITATE (İzosetil Palmitat) (cetyl palmitate) occurs in spermaceti.Excess carbohydrates in the body are converted to ISOCETYL PALMITATE (İzosetil Palmitat). Palmitic acid is the first fatty acid produced during fatty acid synthesis and is the precursor to longer fatty acids. As a consequence, ISOCETYL PALMITATE (İzosetil Palmitat) is a major body component of animals. In humans, one analysis found it to make up 21–30% (molar) of human depot fat, and it is a major, but highly variable, lipid component of human breast milk. Palmitate negatively feeds back on acetyl-CoA carboxylase (ACC), which is responsible for converting acetyl-CoA to malonyl-CoA, which in turn is used to add to the growing acyl chain, thus preventing further palmitate generation.In biology, some proteins are modified by the addition of a palmitoyl group in a process known as palmitoylation. Palmitoylation is important for membrane localisation of many proteins.Palmitic acid is used to produce soaps, cosmetics, and industrial mold release agents. These applications use sodium palmitate, which is commonly obtained by saponification of palm oil. To this end, palm oil, rendered from palm tree (species Elaeis guineensis), is treated with sodium hydroxide (in the form of caustic soda or lye), which causes hydrolysis of the ester groups, yielding glycerol and sodium palmitate.Because it is inexpensive and adds texture and "mouth feel" to processed foods (convenience food), ISOCETYL PALMITATE (İzosetil Palmitat) and its sodium salt find wide use in foodstuffs. Sodium palmitate is permitted as a natural additive in organic products.The aluminium salt is used as a thickening agent of napalm used in military actions.Hydrogenation of ISOCETYL PALMITATE (İzosetil Palmitat) yields cetyl alcohol, which is used to produce detergents and cosmetics.Recently, a long-acting antipsychotic medication, paliperidone palmitate (marketed as INVEGA Sustenna), used in the treatment of schizophrenia, has been synthesized using the oily palmitate ester as a long-acting release carrier medium when injected intramuscularly. The underlying method of drug delivery is similar to that used with decanoic acid to deliver long-acting depot medication, in particular, neuroleptics such as haloperidol decanoate.According to the World Health Organization, evidence is "convincing" that consumption of ISOCETYL PALMITATE (İzosetil Palmitat) increases the risk of developing cardiovascular disease,based on studies indicating that it may increase LDL levels in the blood. Retinyl palmitate is a source of vitamin A added to low-fat milk to replace the vitamin content lost through the removal of milk fat. Palmitate is attached to the alcohol form of vitamin A, retinol, to make vitamin A stable in milk.Treatment of commercially available 2-(decyl)dodecanoic acid or 2-(tetradecyl)ISOCETYL PALMITATE (İzosetil Palmitat) (37) in methanol in the presence of concd sulfuric acid gave the methyl ester 38 in a quantitative yield. In the essentially same way, 3-(nonyl)dodecanoic acid or 3-(tridecyl)ISOCETYL PALMITATE (İzosetil Palmitat) (40) gave the corresponding methyl esters 41 in almost quantitative yields. Reduction of the methyl esters with LiAlH4 in dry ether gave the corresponding alcohols 39 and 42 in good yields, respectively (Scheme 8).11The homologous series with n = 5 and m = 7 includes cis-9,10-methylene-hexadecanoic acid, and the homologous series with n = 5 and m = 9 includes lactobacillic acid (cis-11,12-methylene-octadecanoic acid). The homologous series with n = 7 and m = 6 includes dihydromalvalic acid (systematic name: 2-octyl-cyclopropaneheptanoic acid), and the homologous series with n = 7 and m = 7 includes dihydrosterculic acid (systematic name: cis-9,10-methylene-octadecanoic acid), see Fig. 6.Experimental Hf data (Table A3) in the range of n-heptanoic acid (nC= 7) and ISOCETYL PALMITATE (İzosetil Palmitat) (nC= 16) were used as the training set for deriving a QPPR of the form of Eq. 3 for the n-alkanoic acid series. The uncertainty level for the data ranges between <0.2% to <3%. The resultant parameter values obtained: B0= (3.461 ± 0.076) × 107 and B1= 1.005525 ± 0.026 with a correlation coefficient R2= 0.998967 and a randomly distributed residual plot (Fig. A3). As in the case of the n-mercaptans, the value of B1 is essentially 1.Essential oils are principal components of the leaves of fenugreek with main compounds as (2E)-hexenal (26.61%), ISOCETYL PALMITATE (İzosetil Palmitat) (10.14%) and (E)-β-ionone (7.99%) among others (Riasat et al., 2017). These fragrant molecules are however not the major constituent of the seeds and are not herein addressed as the pharmacologically relevant constituents. In one particular analysis study by Shahinuzzaman et al. (2015), the essential oil constituents of fenugreek seeds were shown to contain fatty acids as major components: decane, 5,6-bis(2,2-dimethylpropylidene)-, (E,Z)- (19.58%), ISOCETYL PALMITATE (İzosetil Palmitat), methyl ester (18.81%) and dihydro methyl jasmonate (10.99%) (Table 17.1). Hence fatty acids and derivatives are the major essential oil components of fenugreek seeds.The content of essential oils of Centaurea species are characterized by the presence of sesquiterpenes skeleton (caryophyllene, eudesmol and germacrene); hydracarbons (tricosane, pentacosane and heptacosane); fatty acids (ISOCETYL PALMITATE (İzosetil Palmitat), tetradecanoic acid, and dodecanoic acid) and monoterpenes (aspinene, terpinene and carvacrol).Common names of fatty acids are more often used than the IUPAC names (Table 31.1). The most common saturated fatty acids, palmitic and stearic acids, contain 16 and 18 carbon atoms, respectively. Their IUPAC names are ISOCETYL PALMITATE (İzosetil Palmitat) and octadecanoic acid, respectively.The aromatics and their derivatives such as benzene, methylbenzene, and phenol, fatty acids such as a ISOCETYL PALMITATE (İzosetil Palmitat), nitrogen-containing compounds such as amines and amides, and other group alcohols, aldehydes, and ketones were oxygen-containing compounds.DL in ethanol-water cosolvent (EWCS) were more dispersive, and their relative content were lower than 10%, except for ISOCETYL PALMITATE (İzosetil Palmitat) ethyl ester with its relative content of 15.06%. Typically, the content of ISOCETYL PALMITATE (İzosetil Palmitat) produced in HTL reached 17.27% but decreased to 9.79% in EWCS and 3.21% in pure ethanol, while the ISOCETYL PALMITATE (İzosetil Palmitat) ethyl ester content increased from 0% in HTL to 15.06% in EWCS, and then up to 38.4% in pure ethanol. Furthermore, the other ethyl esters such as 5,8,11,14-eicosatetraenoic acid, ethyl ester, (all-Z)- and ethyl linoleate were also higher in bio-oil from EWCS and pure ethanol. This indicated that the addition of ethanol into liquefaction system could serve as a substrate, reacting with acidic components like ISOCETYL PALMITATE (İzosetil Palmitat) and obtaining corresponding esters like ISOCETYL PALMITATE (İzosetil Palmitat) ethyl ester, which is known as etherification. Biswas et al. observed from GS-MS of Sargassum tenerrimum algae-derived bio-oil using water as a solvent for HTL at 280°C (STW280) were 3-pyridiol, p-hydroxybiphenyl, ISOCETYL PALMITATE (İzosetil Palmitat), bis(2-ethylhexyl) phthalate, stigmastan-3,5-diene, and hexadecanamide. For C2H5OH as the solvent (ST-E280) the main compounds were ISOCETYL PALMITATE (İzosetil Palmitat)-ethyl ester, ethyl oleate, tetradecanoic acid-ethyl ester, and isosorbide. Hexadecanoic acid-methyl ester, methyl tetradecanoate, 8-octadecenoic acid methyl ester, and methyl hexadec-9-enoate were the compounds found in major concentrations in bio-oil obtained.This compound, composed of cyclic phosphate and cyclopropane-containing ISOCETYL PALMITATE (İzosetil Palmitat), inhibited more than 80% of the affinity-purified calf thymus DNA polymerase α activity at a concentration of 10 μg/mL.Preparation of one diastereomer of cyclopropane-containing ISOCETYL PALMITATE (İzosetil Palmitat) (81) was summarized in Scheme 7, starting with enzymatic hydrolysis of meso diester (74).Palmitic Acid Palmitic acid (also known as ISOCETYL PALMITATE (İzosetil Palmitat)) is a fatty acid that is found naturally in animals and plants and also can be created in laboratory settings. Palmitic acid is widely used in a variety of applications, including personal care products and cosmetics.Palmitic acid (ISOCETYL PALMITATE (İzosetil Palmitat)) has been for long time negatively depicted for its putative detrimental health effects, shadowing its multiple crucial physiological activities. ISOCETYL PALMITATE (İzosetil Palmitat) is the most common saturated fatty acid accounting for 20–30% of total fatty acids in the human body and can be provided in the diet or synthesized endogenously via de novo lipogenesis (DNL). ISOCETYL PALMITATE (İzosetil Palmitat) tissue content seems to be controlled around a well-defined concentration, and changes in its intake do not influence significantly its tissue concentration because the exogenous source is counterbalanced by ISOCETYL PALMITATE (İzosetil Palmitat) endogenous biosynthesis. Particular physiopathological conditions and nutritional factors may strongly induce DNL, resulting in increased tissue content of ISOCETYL PALMITATE (İzosetil Palmitat) and disrupted homeostatic control of its tissue concentration. The tight homeostatic control of ISOCETYL PALMITATE (İzosetil Palmitat) tissue concentration is likely related to its fundamental physiological role to guarantee membrane physical properties but also to consent protein palmitoylation, palmitoylethanolamide (PEA) biosynthesis, and in the lung an efficient surfactant activity. In order to maintain membrane phospholipids (PL) balance may be crucial an optimal intake of ISOCETYL PALMITATE (İzosetil Palmitat) in a certain ratio with unsaturated fatty acids, especially PUFAs of both n-6 and n-3 families. However, in presence of other factors such as positive energy balance, excessive intake of carbohydrates (in particular mono and disaccharides), and a sedentary lifestyle, the mechanisms to maintain a steady state of ISOCETYL PALMITATE (İzosetil Palmitat) concentration may be disrupted leading to an over accumulation of tissue ISOCETYL PALMITATE (İzosetil Palmitat) resulting in dyslipidemia, hyperglycemia, increased ectopic fat accumulation and increased inflammatory tone via toll-like receptor 4. It is therefore likely that the controversial data on the association of dietary ISOCETYL PALMITATE (İzosetil Palmitat) with detrimental health effects, may be related to an excessive imbalance of dietary ISOCETYL PALMITATE (İzosetil Palmitat)/PUFA ratio which, in certain physiopathological conditions, and in presence of an enhanced DNL, may further accelerate these deleterious effects.Palmitic acid (16:0, ISOCETYL PALMITATE (İzosetil Palmitat)) is the most common saturated fatty acid found in the human body and can be provided in the diet or synthesized endogenously from other fatty acids, carbohydrates and amino acids.n average, a 70-kg man is made up of 3.5 Kg of ISOCETYL PALMITATE (İzosetil Palmitat). As the name suggests, ISOCETYL PALMITATE (İzosetil Palmitat) is a major component of palm oil (44% of total fats), but significant amounts of ISOCETYL PALMITATE (İzosetil Palmitat) can also be found in meat and dairy products (50–60% of total fats), as well as cocoa butter (26%) and olive oil (8–20%). Furthermore, ISOCETYL PALMITATE (İzosetil Palmitat) is present in breast milk with 20–30% of total fats.The tight homeostatic control of ISOCETYL PALMITATE (İzosetil Palmitat) tissue concentration is likely related to its fundamental physiological role in several biological functions. Particularly in infants ISOCETYL PALMITATE (İzosetil Palmitat) seems to play a crucial role as recently thoroughly revised by Innis (Innis, 2016). The disruption of ISOCETYL PALMITATE (İzosetil Palmitat) homeostatic balance, implicated in different physiopathological conditions such as atherosclerosis, neurodegenerative diseases and cancer, is often related to an uncontrolled ISOCETYL PALMITATE (İzosetil Palmitat) endogenous biosynthesis, irrespective of its dietary contribution.FA synthesis starts with citrate conversion to acetyl-CoA and then malonyl-CoA, which is then elongated to form palmitate and other FA. Key enzymes in this process are acetyl-CoA carboxylase (ACC), which catalyzes the DNL limiting step reaction, and the FA synthase (FAS). The main sources of citrate for DNL are glucose and glutamine-derived α-ketoglutarate (α-KG), especially under hypoxia or disruption of the mitochondrial oxidative machinery.Palmitic acid, or ISOCETYL PALMITATE (İzosetil Palmitat), is one of the most common saturated fatty acids found in animals, plants, and microorganisms.Palmitic acid is used to produce soaps, cosmetics, and industrial mould release agents.Palmitic acid is also used in the determination of water hardness and is a surfactant of Levovist, an intravenous ultrasonic contrast agent.Palmitic acid, or ISOCETYL PALMITATE (İzosetil Palmitat) in IUPAC nomenclature, is the most common saturated fatty acid found in animals, plants and microorganisms.[9][10] Its chemical formula is CH3(CH2)14COOH, and its C:D is 16:0. As its name indicates, it is a major component of the oil from the fruit of oil palms (palm oil). Palmitic acid can also be found in meats, cheeses, butter, and other dairy products. Palmitates are the salts and esters of ISOCETYL PALMITATE (İzosetil Palmitat). The palmitate anion is the observed form of ISOCETYL PALMITATE (İzosetil Palmitat) at physiologic pH (7.4).Aluminium salts of ISOCETYL PALMITATE (İzosetil Palmitat) and naphthenic acid were combined during World War II to produce napalm. The word "napalm" is derived from the words naphthenic acid and ISOCETYL PALMITATE (İzosetil Palmitat).

ISODECYL PALMITATE,N° CAS : 59231-33-3 / 14779-95-4, Nom INCI : ISODECYL PALMITATE. Nom chimique : Isodecyl palmitate. N° EINECS/ELINCS : 261-672-0. Ses fonctions (INCI) : Emollient : Adoucit et assouplit la peau. Agent d'entretien de la peau : Maintient la peau en bon état

ISODECYL OLEATE Isodecyl Oleate What Is Isodecyl Oleate? Decyl Oleate and Isodecyl Oleate are made from decyl alcohol and oleic acid. Decyl Oleate is made from straight chained decyl alcohol, while Isodecyl Oleate is made from branched chain decyl alcohol. Decyl Oleate and Isodecyl Oleate are used in a variety of cosmetics and personal care products, including makeup, and skin and hair care products. Why is Isodecyl Oleate used in cosmetics and personal care products? Decyl Oleate and Isodecyl Oleate act as lubricants on the skin surface, which gives the skin a soft and smooth appearance. These ingredients also form a thin film on the skin that is neither greasy nor tacky. The unique properties of Decyl Oleate and Isodecyl Oleate facilitate the application and removal of makeup. Scientific Facts: Decyl Oleate and Isodecyl Oleate are made from a naturally occurring fatty acid, oleic acid. Decyl Oleate and Isodecyl Oleate have good lubrication properties and possess low viscosity. Molecular Weight 422.7 g/mol Computed by PubChem 2.1 (PubChem release 2019.06.18) XLogP3-AA 11.8 Computed by XLogP3 3.0 (PubChem release 2019.06.18) Hydrogen Bond Donor Count 0 Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18) Hydrogen Bond Acceptor Count 2 Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18) Rotatable Bond Count 24 Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18) Exact Mass 422.412381 g/mol Computed by PubChem 2.1 (PubChem release 2019.06.18) Monoisotopic Mass 422.412381 g/mol Computed by PubChem 2.1 (PubChem release 2019.06.18) Topological Polar Surface Area 26.3 Ų Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18) Heavy Atom Count 30 Computed by PubChem Formal Charge 0 Computed by PubChem Complexity 373 Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18) Isotope Atom Count 0 Computed by PubChem Defined Atom Stereocenter Count 0 Computed by PubChem Undefined Atom Stereocenter Count 0 Computed by PubChem Defined Bond Stereocenter Count 1 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 3687-46-5 EINECS/ELINCS No: 222-981-6 COSING REF No: 75506 Chem/IUPAC Name: Decyl oleate What Is Decyl Oleate ? Decyl Oleate and Isodecyl Oleate are made from decyl alcohol and oleic acid. Decyl Oleate is made from straight chained decyl alcohol, while Isodecyl Oleate is made from branched chain decyl alcohol. Decyl Oleate and Isodecyl Oleate are used in a variety of cosmetics and personal care products, including makeup, and skin and hair care products. Why is Decyl Oleate used in cosmetics and personal care products? Decyl Oleate and Isodecyl Oleate act as lubricants on the skin surface, which gives the skin a soft and smooth appearance. These ingredients also form a thin film on the skin that is neither greasy nor tacky. The unique properties of Decyl Oleate and Isodecyl Oleate facilitate the application and removal of makeup.Decyl oleate * Made from the naturally occurring fatty acid, oleic acid. Primarily used as a lubricant.Emollient, Skin conditioning It creates a thin, non-greasy film that gives the skin a smooth and soft appearance. It's frequently used used in products geared at removing makeup. You can find this ingredient in cosmetics such as facial moisturizer/lotion, anti-aging treatment, sunscreen, eye shadow, hand & foot cream, conditioner, aftershave and eye cream.Functions: Primarily used as a lubricant. It creates a thin, non-greasy film that gives the skin a smooth and soft appearance. It's frequently used used in products geared at removing makeup. You can find this ingredient in cosmetics such as facial moisturizer/lotion, anti-aging treatment, sunscreen, eye shadow, hand & foot cream, conditioner, aftershave and eye cream. Safety Measures/Side Effects: The Cosmetic Ingredient Review (CIR) Expert Panel has assessed this ingredient as non-toxic and non-irritating, thus determining it as safe to use in cosmetic products. It has been shown to be comedogenic (clog the pores), and should be avoided by those with oily and acne prone skin types.Decyl Oleate and lsodecyl Oleate are esters of oleic acid. Decyl Oleate is used in cosmetic products at concentrations ranging from I 0.1 to > 50%. Isodecyl Oleate is used at concentrations of > 0.1-25%. Animal studies have shown both Decyl Oleate and lsodecyl Oleate to possess low acute oral toxicities in rats with LD50s of > 40 ml/kg, Single application dermal and eye studies with rabbits have shown these materials at 100% concentrations produce little or no irritation. Daily applications of 159b or 100% concentrations for 60 days to the skin of rabbits produced a moderate degree of irritation with both Decyl and lsodecyl Oleate. Neither of the ingredients was found to be a sensitizer when tested in guinea pigs at concentrations of 15%. Repeated insult patch tests containing 1-5'1'0 Decyl Oleate showed no signs of sensitization. Testing with formulations containing 5.5% Decyl Oleate produced a low number of reactions in 402 human subjects in the SchwartzPeck Prophetic Patch Test and 204 subjects with undiluted lsodecyl Oleate on nine subjects showed a total irritation score of 1 .O out of a maximum of 756. It is concluded that, because of both the chemical similarity of these compounds and the similarity of the available animal and human data, Decyl and lsodecyl Oleates warrant a conclusion of safe in the concentrations of present practices and use in cosmetics. ecyl Oleate and lsodecyl Oleate are esters of oleic acid. Formed by ester- D ification of oleic acid with decyl or isodecyl alcohol, they have the following structural formulas: Decyl Oleate- lsodecyl Oleate- CH3 (CH CH=CH(CH2) 7COOCH2 (CH2) 6CH (CH3) 27 Methyl Oleate is a compound chemically related to Decyl Oleate and lsodecyl Oleate. Its structural formula is as follows: CH3 (CH2) 7CH=CH (CH2) 7COOCH 3 The safety of methyl oleate is not under review in this report. Information and data pertaining to this compound are included to permit a more complete appraisal of the safety of Decyl Oleate and lsodecyl Oleate.Some of the chemical and physical properties of these esters are given in Reactivity Unsaturated fatty acids and their esters readily undergo aut~xidation.'~) Methyl oleate can serve as a model for autoxidation reactions which all the oleic acid esters exhibited. This compound undergoes autoxidation to give primarily trans-hydro peroxide^,'^) which are highly unstable and readily decompose to keto and hydroxy keto acids.(6) Some hydroperoxides have been found to possess carcinogenic potential.") Methyl oleate undergoes photochemical decomposition in direct sunlight and in the presence of oxygen to form the ozonide of methyl oleic acid.(*) The most important secondary products of autoxidation include alpha, beta-u nsatu rated carbonyl com pou nds.(5) Hemati n com pou nds, (') metals, (lo) and chlorinated hydrocarbon i nsecticides' ") accelerate the autoxidation reaction by shortening the induction period. Analytical Methods Methyl oleate can be generated in purities of 98% or better by repeated distillation with urea at a low temperature.('2) Analysis of this and related compounds is done by gas-liquid or thin-layer chromatography. The position of the double bond can be determined by von Rudolph's oxidation procedure. Infrared spectroscopy can be used to delineate cis-trans i~omers.('~-~~) Although gas-liquid chromatography remains the preferred routine analytical method for fatty acid ester mixtures, utilization of high performance liquid chromatography (HPLC) is increasing; for the latter has the advantage of identifying polymerized and oxidized esters which the former does not dete. PURPOSE AND FREQUENCY OF USE IN COSMETICS Decyl and lsodecyl Oleates have been widely used in cosmetic products. When applied to the skin alone, they deposit a thin oily film that is neither greasy nor tacky. They have good lubrication properties and possess low viscosity.(") Both materials are used as dispersants and lubricants in cosmetic formulations, and these are particularly important in makeup and makeup removers, in which they are used as wetting agents for iron oxide pigments; particles of such pigment are dispersed and easily suspended. The use of these ingredients facilities the application and removal of a suspension. By virtue of its branched chain structure, lsodecyl Oleate possesses several distinct properties. It has the ability to lower the freezing point of the emulsion phase of products, as well as to control product viscosity. In dispersible bath oils, it forms a white emulsion, giving the tub water a rich and milky appearance. It also has the ability to suspend aluminum chlorohydrate, which makes it valuable for dry antiperspirant formulations. Lipstick formulations have employed lsodecyl Oleate because its coupling properties increase the hardness and strength of the product without reducing its flow characteristics. Table 2 indicates categories of product use and concentrations of use for Decyl and lsodecyl Oleate.('*) The cosmetic product formulation computer printout which is made available by the Food and Drug Administration (FDA) is compiled through voluntary filing of such data in accordance with Title 21 Part 720.4 of the Code of Federal Regulations (1979). Ingredients are listed in prescribed concentration ranges under specific product type categories. Since certain cosmetic ingredients are supplied by the manufacturer at less that 100% concentration, the value reported by the cosmetic formulator may not necessarily reflect the true, effective concentration found in the finished product; the effective concentration in such a case would be a fraction of that reported to the FDA. The fact that data are only submitted within the framework of preset concentration ranges also provides the opportunity for overestimation of the actual concentration of an ingredient in a particular product. An entry at the lowest end of a concentration range is considered the same as one entered at the highest end of that range, thus introducing the possibility of a two- to ten-fold error in the assumed ingredient concentration. The compounds are employed in a variety of cosmetics, including makeup preparations, skin care preparations, and eye-shadow. Concentrations of use range from 50.1 to > for Decyl Oleate and > 0.1-25% for I sod ec y I 0 leate. Products containing these two materials are applied with varying frequency to all areas of the skin. In such formulations as blushers and moisturizing creams, exposure may occur several times a day, while in other cases there may be daily (deodorants) or less frequent (rinses, hair conditioners) applications. This occasional or daily use may extend over a period of years. Animal Toxicology Decyl Oleate: This ingredient was administered to Wistar rats by intragastric intubation at dose levels of 2.5, 5.0, 10.0, 20.0, and 40.0 mllkg COSMETIC INGREDIENT REVIEW two female rats per dose The animals were fasted for 24 hours prior to dosing. All animals were observed daily for 14 days following administration and no deaths were recorded. The acute LD50 of undiluted Decyl Oleate was greater than 40.0 mllkg of body weight. Wistar-derived rats (groups of five male, five female) were dosed by gavage with either 5.0 glkg of undiluted Decyl Oleate or 5.0 glkg of 20 percent Decyl Oleate, 80% mineral The rats were fasted for 18 hours prior to dosing. The animals were observed for signs of pharmacologic activity and drug toxicity at 1, 3, 6, and 24 hours post-dosing, after which daily observations were made for a total of 14 days. One death was recorded for male animals in the diluted sample group, and one female died following treatment with the undiluted sample. No treatment-related effects were noted in any of the surviving animals. Examination of tissues of nons,urvivors and survivors at gross autopsy revealed no abnormalities. lsodecyl Oleate: This ingredient was administered to Wistar rats by intragastric intubation at dose levels of 2.5, 5.0, 10.0, 20.0, and 40.0 mllkg (two female and three male rats per dose The animals were fasted for 24 hours prior to dosing. One death was recorded at the highest dose level. The acute LD50 of undiluted Isodecyl Oleate was reported to be greater than 40.0 ml/kg of body weight. Dermal irritation Decyl Oleate: Drai~e'~~) and Federal Hazardous Substances Labeling Act(22) (FHSA) methods were used to conduct primary skin irritation studies. Test samples of Decyl Oleate (undiluted, 10 percent in corn oil and 20% in mineral oil) were applied (0.5 ml) to clipped areas of intact and abraded albino rabbits skin (six animals in each group). The abrasions were longitudinal, epidermal incisions sufficiently deep to penetrate the stratum corneum, but not so deep as to disturb the dermis. Following application of the test material, the exposed area was covered with a patch and the entire experimental area was sealed with impervious sheeting. The animals were immobilized for a 24-hour period. The mean scores for 24- and 72-hour gradings were averaged to determine final irritation values. The primary irritation index (PII) for undiluted Decyl Oleate was calculated to be 0.28.L25) Itwas also determined that Decyl Oleate had primary irritation indices of 0.08 as a 10 percent solution in corn oil(22) and 0.05 as a 20% solution in mineral A modified Draize method was used to conduct primary dermal irritation studies with undiluted and 15% Decyl Oleate diluted in polyoxyethylene sorbitan stearate (3%), a perservative (2%)) and water; the material was found to be nonirritating (Table 3).("j) ISODECYL OLEATE ISODECYL OLEATE is classified as : Emollient Skin conditioning CAS Number 59231-34-4 EINECS/ELINCS No: 261-673-6 COSING REF No: 34643 Chem/IUPAC Name: Isodecyl oleate Isodecyl Oleate Definition Isodecyl Oleate is a moisturizer that can also be found in cosmetics. As a moisturizer in our products, decyl oleate helps prevent a product or surface, like leather, from drying out by helping it retain moisture. This makes it softer and more pliable. Clinical Assessment of Safety Decyl Oleate: A human repeated insult patch test was conducted on 103 subjects with a skin conditioner containing 1-5% Decyl Oleate. Patches containing approximately 0.2 ml of undiluted sample were applied on Monday, Wednesday, and Friday for three consecutive weeks. Fourteen days after the final insult patch, challenge patches containing the undiluted skin conditioner were applied, and results were graded 48 and 96 hours later. No evidence of sensitization was found; no information on irritation potential was Four formulations of a foundation containing Decyl Oleate (5.5%) were tested in the Schwartz-Peck Prophetic Patch Test and the Draize-Shelanski Repeated Insult Patch Test. "Virtually zero reactions occurred in 402 subjects in the Schwartz-Peck Test and 204 subjects in the Draize-Shelanski Test."(23) lsodecyl Oleate: A single insult (24-hour) occlusive patch test was conducted on 19 human subjects with undiluted lsodecyl Oleate. The test material did not elicit any erythematous reactions. A summary report of the study concluded that Isodecyl Oleate exhibits an acceptably low incidence of primary skin irritation under occlusive patch test According to an industry raw material evaluation, a procedure was undertaken with lsodecyl Oleate under the conditions of a Maibach-type Cumulative lrritancy Assay. When lsodecyl Oleate was applied undiluted under patch conditions to the skin of nine subjects for 21 consecutive days, it was found to have a total irritation score of 1 .O out of a maximum possible 756.(30) SUMMARY Decyl Oleate and lsodecyl Oleate are esters of oleic acid. Decyl Oleate is used in cosmetic products at concentrations ranging from 10.1 to >50°/o. lsodecyl Oleate is used at concentrations of > 0.1 -25%. Animal studies have shown Decyl Oleate and lsodecyl Oleate to possess low acute oral toxicities in rats; both have LD50s of > 40 mllkg. Single application dermal and eye studies with rabbits have shown that these materials in concentrations up to 100% produce little or no irritation. When 15% or 100°/o concentrations were applied to the skin of rabbits daily for 60 days, both Decyl Oleate and lsodecyl Oleate produced moderate degrees of irritation. Neither ingredient was found to be a sensitizer when it was tested in guinea pigs at concentrations of 15%. Repeated human insult patch tests on 103 subjects with a skin conditioner containing 1-5% Decyl Oleate showed no signs of sensitization. Industrial testing with formulations containing 5.5% Decyl Oleate produced a low number of reactions in 402 human subjects in the Schwartz-Peck Prophetic Patch Test and in 204 subjects in the Draize-Shelanski Patch Test. Repeated insult patch tests with undiluted Isodecyl Oleate on an unspecified number of human subjects showed a total irritation score of 1 .O out of a possible maximum of 756. A single insult occlusive patch test on 19 human subjects with undiluted lsodecyl Oleate produced a low level of primary skin irritation. No chronic, oral subchronic, carcinogenicity, mutagenicity, or teratogenicity animal testing data were available to the Panel. Nor were there any phototoxicity or photosensitization studies in humans.

ISODECYL STEARATE, N° CAS : 31565-38-5, Nom INCI : ISODECYL STEARATE, Nom chimique : Isodecyl stearate, N° EINECS/ELINCS : 250-704-9,Ses fonctions (INCI) : Emollient : Adoucit et assouplit la peau, Agent d'entretien de la peau : Maintient la peau en bon état

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

cas no 143-28-2 cis-9-Octadecen-1-ol; 9-Octadecen-1-ol; (Z)-9-octadecen-1-ol; Ocenol; Oleic alcohol; Oleo alcohol; Oleol; Octadec-9-en-1-ol; Octadec-9Z-enol;

isononanal; octanal, 7-methyl-; 7-methyloctanal; isononan-1-al CAS NO:35127-50-5

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

cas no 40379-24-6 Acetic acid, isononyl ester; 7-methyloctyl acetate; trimethylhexyl Acetate;

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.

Isononylamin;ISONONYLAMINE;isononanamine;7-methyloctylamine;7-Methyloctan-1-amine;ISONONYLAMINE MIXTURE OF ISOMERIC &;isononylamine,mixtureofisomericnonylamines;Isononylaminemixtureofisomericnonylamines(g.c.) CAS No.27775-00-4

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

Isostearic acid, Isooctadecanoic acid, Isomerized oleic acid, Oleic acid isomers, Branched stearic acid, Modified stearic acid, Oleate isomers, Isostearate, Altered stearic acid, Isomerized fatty acid, Oleic acid derivatives, Oleate mixture, Branched-chain fatty acid, Isomer-enriched stearate, Modified oleic acid, Isomeric stearate, Oleic acid analogs, Isomerized triglyceride, Altered lipid chain, Isomer-rich fatty acid, Oleate complex, Isomer-enriched oleate, Branched-chain triglyceride, Isostearic triglyceride, Oleate derivative, Isomerized lipid, Modified triglyceride, Isostearic acid blend, Isomeric lipid, Oleic acid structural variant, Branched fatty acid chain, Isomerized stearate ester, Isostearate blend, Oleic acid homologs, Isomer-rich fatty acid blend, Branched stearate derivative, Oleate isomer mixture, Isomeric triglyceride, Oleate isomer blend, Isostearate isomer blend, Modified stearate ester, Oleic acid analog mixture, Altered stearate ester, Isostearic acid complex, Branched-chain stearate, Oleate structural variant, Isomerized fatty acid blend, Altered lipid ester, Modified oleate, Isomer-rich stearate, Oleic acid isomer fraction, Branched triglyceride, Isostearate homologs, Oleic acid isomerization product, Isomerized lipid fraction



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

C10-12 alkane/cycloalkane; naphtha (petroleum) hydrotreated heavy cas no :64742-48-9

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

2-Methylbutane; Isoamylhydride; Butane, 2-methyl-; Dimethylethylmethane; Ethyldimethylmethane; 1,1,2-Trimethylethane; 1,1-dimethylpropane; iso-Pentane; Propane, dimethyl-; CAS NO : 78-78-4

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.