Pentyl propanoate is a propanoate ester of pentan-1-ol.
Definition
Pentyl propanoate is a propanoate ester of pentan-1-ol. It has a role as a fungal metabolite. It is functionally related to a pentan-1-ol.
Source: PubChem
US FDA substance register · UNII 826P0596UJ · registered name AMYL PROPIONATE · 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
- 624-54-4
- EC No.EU chemical inventory number
- 210-852-7
- DTXSIDUS EPA chemical ID
- DTXSID4041606
- DTXCIDUS EPA compound ID
- DTXCID2021606
- IUPAC
- Pentyl propanoate
- Molecular formula
- C8H16O2
- Molecular weight
- 144.214 g/mol
Measured properties
- Appearance
- N-pentyl propionate is a colorless liquid with an apple-like odor. Floats on water. (USCG, 1999) · Liquid
- Boiling point
- 167.00 to 169.00 °C. @ 760.00 mm Hg
- Melting point
- -73.1 °C
- Solubility
- 0.81 mg/mL at 25 °C
- Density
- 0.869 to 0.873 at 68 °F (USCG, 1999)
- Colour
- colourless
- Melting/freezing point
- -73.1 ℃
- Initial boiling point and range
- 168.6 ℃
- Flash point
- 57.2 ℃(c.c.)
- Flammability (solid, gas)
- flammable
- Vapour pressure
- 3.6 ㎜Hg (at 25 ℃)
- Water solubility
- 810 ㎎/ℓ (at 25 ℃)
- Vapour density
- 4.97 (air=1)
- Relative density
- 0.872 (at 20 ℃)
- n-Octanol/water partition coefficient (Kow)
- 2.83 (est.)
- Auto-ignition temperature
- 356 ℃
- Viscosity
- 1.04 cP (at 20 ℃)
- Molecular weight
- 144.22
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 10 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.
- Solvent4
- Fragrance3
- Processing aids not otherwise specified2
- Flavouring and nutrient1
Source: US EPA CompTox dashboard
Irritation and sensitisation studies
4 skin studies and 2 eye studies are on record.
The study conclusions largely agree (100%). These tests are on the raw material itself; irritation at the amount in a finished product is a different question.
See all 6 studies
- Classification not possible
Skin Sensitization · Screening - Not likely to be sensitizing
skin sensitisation: in vivo (LLNA) · Screening · according to OECD Guideline 429 (Skin Sensitisation: Local Lymph Node Assay) according to EU Method B.42 (Skin Sensitisation: Local Lymph Node Assay) according to EPA OPPTS 870.2600 (Skin Sensitisation) - Studies Indicate No Significant Irritation
skin irritation: in vivo · Screening · OECD Guideline 404 (Acute Dermal Irritation / Corrosion) equivalent or similar to - Classification not possible
Skin Irritation · Screening - Classification not possible
Eye Irritation · Screening - Studies Indicate No Significant Irritation
eye irritation: in vivo · Screening · OECD Guideline 405 (Acute Eye Irritation / Corrosion) equivalent or similar to
Source: US EPA CompTox dashboard
Linked databases 14
- Australian Industrial Chemicals Inventory (AICIS)
- ChEBI
- EU CosIng ingredient list 2
- Korea toxic substances GHS register (NIER)
- KOSHA safety data sheets (Korea)
- 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
- Wikipedia · English · Japanese