Cis-3-hexenyl formate supplier

Name
cis-3-Hexenyl formate
EINECS 251-532-7
CAS No. 33467-73-1
Article Data1
CAS DataBase
Density 0.906 g/cm³
Solubility
Melting Point -62.68°C (estimate)
Formula C₇H₁₂O₂
Boiling Point 158.9 °C at 760 mmHg
Molecular Weight 128.171
Flash Point 50.2 °C
Transport Information UN 3272 3/PG 3
Appearance colourless to pale yellow liquid with a green, vegetable odour
Safety 16-26-36
Risk Codes 10-36/38
Molecular Structure
Hazard Symbols Xi
Synonyms 3-Hexen-1-ol,formate, (3Z)- (9CI);3-Hexen-1-ol, formate, (Z)- (8CI);(Z)-3-Hexen-1-ylformate;(Z)-3-Hexenyl formate;
PSA 26.30000
LogP 2.15160

Cis-3-hexenyl formate Chemical Properties

Molecular Formula: C₇H₁₂O₂
Molar mass: 128.169 g/mol
EINECS: 221-051-7
Density: 0.906 g/cm³
Flash Point: 50.2 °C
Index of Refraction: 1.429
Boiling Point: 158.9 °C at 760 mmHg
Vapour Pressure: 2.57 mmHg at 25°C
Appearance: Colorless to pale yellow liquid, fresh fruit aroma, a pungent smell of grass and vegetables taste
Solubility: Soluble in ethanol, propylene glycol, and the majority of non-volatile oil, not dissolve in water
Product categories of Cis-3-hexenyl formate (33467-73-1): Flavors and Fragrances;Alphabetical Listings
Structure of Cis-3-hexenyl formate (33467-73-1):

XLogP3-AA: 1.9
H-Bond Donor: 0
H-Bond Acceptor: 2
IUPAC Name: [(Z)-hex-3-enyl] formate
Canonical SMILES: CCC=CCCOC=O
Isomeric SMILES: CC/C=C\CCOC=O
InChI: InChI=1S/C7H12O2/c1-2-3-4-5-6-9-7-8/h3-4,7H,2,5-6H2,1H3/b4-3-
InChIKey: XJHQVZQZUGLZLS-ARJAWSKDSA-N

Cis-3-hexenyl formate Uses

In GB 2760-86, Cis-3-hexenyl formate (33467-73-1) has been provided for the use of spices in food.

Cis-3-hexenyl formate Production

The production can be formed from the esterification of cis -3 - hexenol with formic acid.

Cis-3-hexenyl formate Toxicity Data With Reference

rabbit	LD50	skin	> 5gm/kg (5000mg/kg)		Food and Cosmetics Toxicology. Vol. 17, Pg. 797, 1979.
rat	LD50	oral	> 5gm/kg (5000mg/kg)		Food and Cosmetics Toxicology. Vol. 17, Pg. 797, 1979.

Cis-3-hexenyl formate Consensus Reports

Reported in EPA TSCA Inventory.

Cis-3-hexenyl formate Safety Profile

A skin irritant. When heated to decomposition it emits acrid smoke and irritating vapors.
Hazard Codes: Xi
Risk Statements:
10: Flammable
36: Irritating to the eyes
38: Irritating to the skin
Safety Statements:
16: Keep away from sources of ignition - No smoking
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing

Cis-3-hexenyl formate Specification

Cis-3-hexenyl formate (33467-73-1) also can be called Cis-3-Hexen-1-ol formate ; 3-Hexenyl formate, cis- ; 3-Hexenyl methanoate, cis- ; Cis-.beta.-Hexenyl Formate ; Beta,gamma-Hexenyl methanoate ; (Z)-Hex-3-enyl formate .

Product Name

cis-3-Hexenyl formate