ChemicalBook--->CAS DataBase List--->112-32-3

112-32-3

112-32-3 Structure

112-32-3 Structure
IdentificationBack Directory
[Name]

OCTYL FORMATE
[CAS]

112-32-3
[Synonyms]

FEMA 2809
Octylformiat
OCTYL FORMATE
OCLyl ForMate
1-octylformate
n-octylformate
Octylmethanoate
n-Octyl formate
octyl methanoate
Formic acid octyl
n-Octyl methanoate
OCTYL ALCOHOL FORMATE
OCTYL FORMATE USP/EP/BP
FORMIC ACID OCTYL ESTER
OCTYL FORMATE 97+% FCC
FORMIC ACID OCTYL ESTER FCC
[EINECS(EC#)]

203-959-5
[Molecular Formula]

C9H18O2
[MDL Number]

MFCD00046147
[MOL File]

112-32-3.mol
[Molecular Weight]

158.24
Chemical PropertiesBack Directory
[Melting point ]

-39.1°C
[Boiling point ]

87-89 °C20 mm Hg(lit.)
[density ]

0.877 g/mL at 25 °C(lit.)
[FEMA ]

2809 | OCTYL FORMATE
[refractive index ]

n20/D 1.418(lit.)
[Fp ]

171 °F
[color ]

Colorless liquid
[Odor]

fruity odor
[biological source]

synthetic
[Odor Type]

fruity
[JECFA Number]

122
[Henry's Law Constant]

1.7×10-3 mol/(m3Pa) at 25℃, Yaws (2003)
[Major Application]

flavors and fragrances
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C9H18O2/c1-2-3-4-5-6-7-8-11-9-10/h9H,2-8H2,1H3
[InChIKey]

AVBRYQRTMPHARE-UHFFFAOYSA-N
[SMILES]

[H]C(=O)OCCCCCCCC
[LogP]

3.49
[CAS DataBase Reference]

112-32-3
[EPA Substance Registry System]

Formic acid, octyl ester (112-32-3)
Hazard InformationBack Directory
[Definition]

ChEBI: A formate ester of octan-1-ol.
[Description]

Octyl formate has a fruity odor with a rose-orange note and a bitter flavor that is refreshingly fruity green at low concentrations. May be prepared by esterification of n-octyl alcohol with formic acid; by boiling n-octyl chloride with formamide in the presence of small amounts of HCl.
[Chemical Properties]

n-Octyl formate has a fruity odor with a rose–orange note and a bitter flavor, refreshingly fruity green at low concentrations.
[Occurrence]

Reported found in Scotch spearmint oil and roast beef.
[Uses]

OCTYL FORMATE is used as flavorings. Primarily used to formulate flavorings such as peach, apricot, citrus, and mixed fruit flavors.
[Preparation]

By esterification of n-octyl alcohol with formic acid; by boiling n-octyl chloride with formamide in the presence of small amounts of HCl.
[General Description]

Octyl formate is one of the flavor volatile components reported in blackberries, mushrooms and certain varieties of rice.
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36/37/39
[WGK Germany ]

2
[RTECS ]

LQ9290000
[TSCA ]

TSCA listed
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
[Safety Profile]

A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.
[Toxicity]

skn-rbt 500 mg/24H MOD FCTXAV 17,883,79
Raw materials And Preparation ProductsBack Directory
[Raw materials]

(-)-MENTHYL CHLOROFORMATE-->1-Chlorooctane
[Preparation Products]

2-ethyl-1,3-dioxolane-->2-HEXYL-1,3-DIOXOLANE
Spectrum DetailBack Directory
[Spectrum Detail]

OCTYL FORMATE(112-32-3)1HNMR
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