顺式-3-己烯醇甲酸酯

Description

cis-3-hexenyl formate is identified by CAS 33467-73-1, molecular formula C7H12O2 and molecular weight 128.08 g/mol. UNII E34OB83TYM; ChEBI 173502; InChIKey XJHQVZQZUGLZLS-ARJAWSKDSA-N. Boiling Point: 72.00 °C. @ 40.00 mm Hg; Boiling Point: 155 °C; Density: 0.898-0.918.

Identification

CAS Registry Number	33467-73-1
PubChem CID	5365587
Molecular formula	C7H12O2
Molecular weight	128.08 g/mol
IUPAC name	[(Z)-hex-3-enyl] formate
InChIKey	XJHQVZQZUGLZLS-ARJAWSKDSA-N
UNII (FDA)	E34OB83TYM
ChEBI ID	CHEBI:173502
FEMA number	3353
JECFA number	123

Computed Descriptors

Molecular Weight	128.17
XLogP3	1.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	5
Exact Mass	128.083729621
Monoisotopic Mass	128.083729621
Topological Polar Surface Area	26.3
Heavy Atom Count	9
Formal Charge	0

Physical & Chemical Properties

Boiling Point	72.00 °C. @ 40.00 mm Hg
Boiling Point	155 °C
Density	0.898-0.918
Refractive Index	1.417-1.437

Physical description & handling notes

• Liquid
• colourless to pale yellow liquid with a green, vegetable odour
• slightly
• soluble in alcohol, propylene glycol, most fixed oils; practically insoluble in water
• (in ethanol)

Regulatory Status

Regulatory & Food Contact	EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Green No safety concern at current levels of intake when used as a flavouring agent

GHS Hazard Classification

Reported hazard statements	H226 (100%)

Documented Uses

• Flavoring Agents -> JECFA Flavorings Index
• Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
• 3-Hexen-1-ol, 1-formate, (3Z)-: ACTIVE

Synonyms

cis-3-Hexenyl formate; 33467-73-1; (Z)-Hex-3-enyl formate; cis-3-Hexen-1-ol formate; cis-beta-Hexenyl formate; FEMA No. 3353; 3-Hexen-1-ol, formate, (3Z)-; beta,gamma-Hexenyl methanoate; 3-HEXEN-1-OL, FORMATE, (Z)-; (Z)-3-Hexenyl formate; 3-Hexenyl formate, cis-; 3-Hexenyl methanoate, cis-; (z)-3-hexen-1-yl formate; 3-Hexenyl formate, (3Z)-; EINECS 251-532-7; E34OB83TYM

Frequently Asked Questions

What are the CAS number and molecular formula of cis-3-hexenyl formate?

CAS 33467-73-1; molecular formula C7H12O2; molecular weight 128.08 g/mol.

What other names is cis-3-hexenyl formate known by?

cis-3-Hexenyl formate, 33467-73-1, (Z)-Hex-3-enyl formate, cis-3-Hexen-1-ol formate, cis-beta-Hexenyl formate, FEMA No. 3353.

What is the regulatory status of cis-3-hexenyl formate?

Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; Flavoring Agents.

Is cis-3-hexenyl formate classified as hazardous?

Hazard statements reported: H226.

What are the key physical properties of cis-3-hexenyl formate?

Boiling Point: 72.00 °C. @ 40.00 mm Hg; Boiling Point: 155 °C; Density: 0.898-0.918; Refractive Index: 1.417-1.437.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.