3-HEXENYLACETATE

Synonyms: 3-Hexenylacetate; (Z)-3-Hexenyl acetate; (Z)-3-Hexen-1-ol acetate; cis-3-Hexen-1-yl acetate; cis-3-Hexenol acetate; cis-3-Hexenyl acetate; cis-3-Hexenyl ethanoate; Leaf acetate;

3-HEXENYLACETATE
 

PRODUCT IDENTIFICATION

CAS RN

 3681-71-8, 25152-87-8

EINECS RN

 222-960-1

FORMULA

 CH3CO2CH2CH2CH=CHC2H5

MOLE WEIGHT

 142.20

SMILES

 C(C\C=C/CC)OC(C)=O
H.S. CODE 2915.39.4550

CLASSIFICATION

Flavors and Fragrances

EXTRA NOTES

 FEMA No. 3171
Natural occurrence: Apple, melon peach, pear, raspberry, strawberry, tomato and Virginia tobacco. 

 

PHYSICAL AND CHEMICAL PROPERTIES

PHYSICAL STATE

 clear mobile oil

MELTING POINT

  

BOILING POINT

 176 C

DENSITY

 0.897 - 0.905

SOLUBILITY IN WATER

 Insoluble

SOLVENT SOLUBILITY

 Soluble in alcohol

pH

 

log Pow

  
HENRY LAW CONSTANT  
OH RATE CONSTANT 7.80E-11 cm3/molecule-sec

VAPOR PRESSURE

  

REFRACTIVE INDEX

 1.423 - 1.429

FLASH POINT

57 C

 
STABILITY AND REACTIVITY
STABILITY Stable under normal conditions

INCOMPATIBLE MATERIALS

Strong oxidizing agents.
DECOMPOSITION PRODUCTS

Carbon oxides, nitrogen oxides
POLYMERIZATION

Has not been reported.

NFPA RATINGS

Health: 2. Flammability: 0, Reactivity: 0

 

SAFETY

HAZARD NOTES

OSHA Hazards: Toxic by ingestion

EYE

May cause eye irritation.

SKIN

May be harmful if absorbed through skin. May cause skin irritation.

INGESTION

Toxic if swallowed.

INHALATION

May be harmful if inhaled. May cause respiratory tract irritation.

CHRONIC

 

 

TRANSPORT & REGULATORY INFORMATION

UN NO.

 3277
HAZARD CLASS

3
PACKING GROUP

III

HAZARD SYMBOL

 

RISK PHRASES

 

SAFETY PHRASES

 

 

EXTERNAL LINKS & GENERAL DESCRIPTION

Wikipedia Linking (Leaf Alcohol)

Google Scholar Search

http://www.chemicalland21.com/
Flavouring Substances Chemical Group 4: Non-conjugated and accumulated unsaturated straight-chain and branched-chain aliphatic primary alcohols/aldehydes/acids, acetals and esters with esters containing unsaturated alcohols and acetals containing unsaturated alcohols or aldehydes. No aromatic or heteroaromatic moiety as a component of an ester or acetal.

 

SALES SPECIFICATION

 

FCC

APPEARANCE

clear to pale yellow liquid

ODOR

powerful green note odor
PURITY 98.0% (sum of isomers)

REFRACTIVE INDEX

1.425 - 1.429 at 20 C

SPECIFIC GRAVITY

0.896 - 0.901 at 25 C

ACID VALUE

0.0 - 1.0

 

NATURAL

APPEARANCE

clear to pale yellow liquid

ODOR

powerful green note odor
PURITY 96.0% (sum of isomers)

REFRACTIVE INDEX

1.425 - 1.429 at 20 C

SPECIFIC GRAVITY

0.896 - 0.901 at 25 C

ACID VALUE

0.0 - 1.0

 

PRICE INFORMATION