Allyl butyrate is a fatty acid ester.
Definition
Allyl butyrate is a fatty acid ester.
Source: PubChem
US FDA substance register · UNII DH3T4NN0KO · registered name ALLYL BUTYRATE · single chemical substance
Cosmetic roles
Safety & regulatory references
- Restricted
- United Kingdom
Source: EU Cosmetics Regulation · MFDS (Korea) cosmetic regulatory information · UK cosmetics regulations (OPSS)
European Union
- Other : Level of free allyl alcohol in the ester should be less than 0.1%
Source: MFDS (Korea) cosmetic regulatory information
Not classified under Korea’s toxic-substance GHS list · existing chemical substance
EU Cosmetics Regulation, Annex III (restricted substances), entry 135
Restriction III/135 · Other restriction: ban substances that deplete the ozone layer
Source: EU CosIng ingredient list
More data — names, identifiers, properties, test records, literature
Names & identifiers
- CAS No.chemical registry number
- 2051-78-7
- EC No.EU chemical inventory number
- 218-129-8
- DTXSIDUS EPA chemical ID
- DTXSID0047666
- DTXCIDUS EPA compound ID
- DTXCID8027666
- IUPAC
- Prop-2-en-1-yl butanoate
- Molecular formula
- C7H12O2
- Molecular weight
- 128.171 g/mol
Measured properties
- Appearance
- Liquid · Colourless liquid with a peach/apricot odour
- Boiling point
- 142.00 to 143.00 °C. @ 760.00 mm Hg · 44-45 °C (15mm Hg)
- Melting point
- -80 °C
- Solubility
- Insoluble in water and soluble in ethanol and oils · (in ethanol)
- Density
- 0.897-0.902
- Colour
- colourless
- Melting/freezing point
- -62.69 ℃
- Initial boiling point and range
- 142 ℃
- Flash point
- 41.67 ℃
- Flammability (solid, gas)
- not flammable
- Vapour pressure
- 1.333 ㎪ (39.67℃)
- Water solubility
- 1233 ㎎/ℓ (25℃)
- Vapour density
- 0.9 g/㎤
- n-Octanol/water partition coefficient (Kow)
- 2.2 (log Pow)
Values measured on the substance itself. The KOSHA data are a reference for writing and reviewing safety data sheets, not a specification for a commercial raw material.
Source: PubChem · KOSHA safety data sheets (Korea)
What products actually use it for
What the 4 products reported to the US EPA with this ingredient use it for. Products outside cosmetics are included, so the top few rows are its main uses.
- Flavouring and nutrient2
- Fragrance2
Source: US EPA CompTox dashboard
Irritation and sensitisation studies
4 skin studies and 1 eye studies are on record.
The studies disagree (the most common conclusion covers 33%), so they do not establish that this ingredient is irritating. These tests are on the raw material itself; irritation at the amount in a finished product is a different question.
See all 5 studies
- Skin corrosion/irritation - Category 2
Skin Irritation · Screening - Not likely to be sensitizing
skin sensitisation: in vivo (non-LLNA) · Screening · according to other guideline: as mentioned below - Severe Irritation
skin irritation: in vivo · Screening · other guideline: as mentioned below according to - Not likely to be sensitizing
skin sensitisation · Screening · according to other guideline: as mentioned below - Severe Irritation
eye irritation: in vivo · Screening · other guideline: as mentioned below according to
Source: US EPA CompTox dashboard
Linked databases 19
- Australian Industrial Chemicals Inventory (AICIS)
- ChEBI
- ChEMBL
- EU CosIng ingredient list 2
- EU Cosmetics Regulation
- EU restricted substances (Annex III)
- Korea toxic substances GHS register (NIER)
- KOSHA safety data sheets (Korea)
- MFDS (Korea) cosmetic regulatory information 2 3
- NIST Chemistry WebBook
- PubChem 2
- UK cosmetics regulations (OPSS)
- UniChem cross-reference IDs
- US EPA CompTox dashboard 2
- US EPA DSSTox chemical database
- US FDA substance registration (GSRS)
- US FDA Unique Ingredient Identifier (UNII)
- Wikidata
- Wikipedia · Japanese