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cis-3-Hexenyl Acetate

cis-3-Hexenyl Acetate Basic information
Product Name:cis-3-Hexenyl Acetate
Synonyms:Zinc05225119;cis-3-Hexenyl acetate,(3Z)-C-3-Hexenyl acetate, 3-Hexen-1-ol, Leaf acetate;VERDURAL;CIS-3-HEXENYL ACETATE 98+% FCC;Leaf Acetate or CIS-3-Hexenyl Acetate 98%;CIS-3-Hexenyl Acetate 98%;Leaf acetate cis-3-Hexenyl acetate;Z-3-hexenyl-1-acetate
CAS:3681-71-8
MF:C8H14O2
MW:142.2
EINECS:222-960-1
Product Categories:
Mol File:3681-71-8.mol
cis-3-Hexenyl Acetate Structure
cis-3-Hexenyl Acetate Chemical Properties
Boiling point 75-76 °C23 mm Hg(lit.)
density 0.897 g/mL at 25 °C(lit.)
vapor pressure 2.14hPa at 25℃
FEMA 3171 | CIS-3-HEXEN-1-YL ACETATE
refractive index n20/D 1.427(lit.)
Fp 135 °F
storage temp. Inert atmosphere,Room Temperature
form neat
color Colorless to Almost colorless
Odorat 10.00 % in dipropylene glycol. fresh green sweet fruity banana apple grassy
Odor Typegreen
Water Solubility 1.11g/L at 20℃
JECFA Number134
BRN 1721854
LogP2.7 at 30℃
CAS DataBase Reference3681-71-8(CAS DataBase Reference)
NIST Chemistry Reference3-Hexen-1-ol, acetate, (Z)-(3681-71-8)
EPA Substance Registry System3-Hexen-1-ol, acetate, (3Z)- (3681-71-8)
Safety Information
Risk Statements 36/38-10
Safety Statements 26-36-24/25
RIDADR UN 3272 3/PG 3
WGK Germany 2
RTECS MP8425050
TSCA Yes
HazardClass 3
PackingGroup III
HS Code 29153900
toxicityBoth the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg (Wohl, 1974).
MSDS Information
ProviderLanguage
(Z)-3-Hexen-1-ol acetate English
SigmaAldrich English
ALFA English
cis-3-Hexenyl Acetate Usage And Synthesis
Descriptioncis-3-Hexen-1 -y 1-acetate has a powerful green, floral note reminiscent of banana. It may be prepared by acetylation of the corresponding alcohol.
Chemical Propertiescis-3-Hexen-1-yl acetate has a powerful, green, fruity, floral note reminiscent of banana.
Chemical Properties(Z)-3-Hexenyl Acetate has been identified in many fruit aromas and green tea. It is a prototype for green odors and is often used in combination with (Z)-3-hexenol.
Chemical PropertiesColorless liquid
OccurrenceReported found in apple, bilberry, guava, strawberry, black and green tea, yellow and purple passion fruit, citrus peel oils, melon, peach, raspberry, pear, pineapple, melon, celery, tomato, corn mint oil, spearmint oil, brandies, grape wines, soybeans, olive, plum, plumcot, starfruit, mango, cauliflower, dill, lovage, corn oil, nectarines, Chinese quince and chamomile oil.
UsesLeaf Acetate increased leaf-feeding herbivores’ egg predation rates by a generalist predator. As a consequence, a plant could reduce the number of herbivores by more than 90% by releasing volatiles.
PreparationBy acetylation of the corresponding alcohol
DefinitionChEBI: An acetate ester that results from the formal condensation of acetic acid with (Z)-hex-3-en-1-ol.
Taste threshold valuesTaste characteristics at 10 ppm: green, fruity, apple and pear with fresh tropical nuances
Synthesis Reference(s)Canadian Journal of Chemistry, 65, p. 2327, 1987 DOI: 10.1139/v87-388
Flammability and ExplosibilityFlammable
cis-3-Hexenyl Acetate Preparation Products And Raw materials
Raw materialsFEMA 2561-->TRANS-3-HEXENYL ACETATE-->TRANS,TRANS-2,4-HEXADIENYL ACETATE-->ACETYL COENZYME A TRILITHIUM SALT TRIHYDRATE-->Leaf alcohol
Bornyl acetate Ferrous acetate STANNOUS ACETATE [(2-Oxo-1,2-dihydroquinolin-4-yl)methyl](acetylamino)malonic acid diethyl ester cis-3-Hexenyl formate Allyl phenoxyacetate Propyleneglycol alginate ETHYLENEDIAMINE TETRAKIS(PROPOXYLATE-BLOCK-ETHOXYLATE) TETROL Diphenolic acid CIS-3-HEXENE cis-3-Hexenyl phenylacetate 5-Chlorovaleric acid CIS-3-HEXENYL SALICYLATE ACETATE cis-2-Hexenyl acetate CIS-3-HERENYL BUTYRATE Leaf alcohol CIS-3-HEXENYL ACETATE Hexenyl Acetate
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