Pentyl octanoate is an octanoate ester obtained by the formal condensation of carboxy group of octanoic acid with pentan-1-ol.
Definition
Pentyl octanoate is an octanoate ester obtained by the formal condensation of carboxy group of octanoic acid with pentan-1-ol. It has a role as a flavouring agent and a plant metabolite. It is functionally related to a pentan-1-ol.
Source: PubChem
US FDA substance register · UNII 1KWP15429R · registered name AMYL OCTANOATE · single chemical substance
Cosmetic roles
Safety & regulatory references
Not classified under Korea’s toxic-substance GHS list · existing chemical substance
More data — names, identifiers, properties, test records, literature
Names & identifiers
- CAS No.chemical registry number
- 638-25-5
- EC No.EU chemical inventory number
- 211-328-0
- DTXSIDUS EPA chemical ID
- DTXSID5060932
- DTXCIDUS EPA compound ID
- DTXCID0044107
- IUPAC
- Pentyl octanoate
- Molecular formula
- C13H26O2
- Molecular weight
- 214.349 g/mol
Measured properties
- Appearance
- Liquid · colourless liquid with a fruity, orris odour
- Boiling point
- 260 °C
- Melting point
- -34 - -35 °C
- Solubility
- soluble in alcohol, most fixed oils, slightly soluble in propylene glycol, insoluble in glycerol, water · 1 ml in 7 ml 80% alcohol (in ethanol)
- Density
- 0.855-0.8562
Values measured on the substance itself, not a specification for a commercial raw material.
Source: PubChem
What products actually use it for
What the 6 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 nutrient3
- Fragrance3
Source: US EPA CompTox dashboard
Linked databases 12
- Australian Industrial Chemicals Inventory (AICIS)
- ChEBI
- EU CosIng ingredient list 2
- Korea toxic substances GHS register (NIER)
- NIST Chemistry WebBook
- PubChem 2
- 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