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trans-2-Hexenyl acetate

trans-2-Hexenyl acetate structure

CAS No:
2497-18-9
Formula:
C8H14O2
Chemical Name:
trans-2-Hexenyl acetate
Synonyms:
2-Hexen-1-ol,1-acetate,(2E)-;2-Hexen-1-ol,acetate,(E)-;2-Hexen-1-ol,acetate,(2E)-;trans-2-Hexenyl acetate;(E)-2-Hexenyl acetate;(E)-2-Hexen-1-yl acetate;(2E)-Hexenyl acetate;(E)-1-Acetoxy-2-hexene;(E)-2-Hexen-1-ol acetate;Acetic acid (E)-2-hexenyl ester
Categories:
Cosmetic Ingredient > Perfuming

Description

2-Hexen-1-yl acetate has a pleasant, fruity odor and corresponding taste. clear colorless to slightly yellow liquid (E)-2-Hexenyl Acetate occurs in many fruits and in some essential oils, for example, peppermint. It is a fresh, fruity, slightly green-smelling liquid and is used in fruit flavors.

Colourless to pale yellow liquid; Powerful green, fruity aroma

(E)-hex-2-enyl acetate is an acetate ester resulting from the formal condensation of the hydroxy group of (E)-hex-2-en-1-ol with the carboxy group of acetic acid. It has a role as a plant metabolite and a flavouring agent. It is an acetate ester and an olefinic compound. It derives from an (E)-hex-2-en-1-ol.

trans-2-Hexenyl acetate Basic Attributes

Molecular Weight：

142.2

Exact Mass：

142.20

BRN：

1721851

EC Number：

219-680-7

UNII：

XDV436N45E

HScode：

29153900

Characteristics

PSA：

26.3

XLogP3：

Appearance：

Colourless to pale yellow liquid; Powerful green, fruity aroma

Density：

0.9±0.1 g/cm3

Melting Point：

-65.52°C (estimate)

Boiling Point：

166 °C

Flash Point：

137 °F

Refractive Index：

1.433

Water Solubility：

Very slightly soluble in water; Soluble in oils

Vapor Pressure：

1.87mmHg at 25°C

Safety Information

Packing level：

Ⅲ

Hazard category：

Transport codes：

UN 3272 3/PG 3

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36-37/39

RTECS Number：

MP8425000

Marks：

Stability/Shelf Life：

Stable. Combustible. Incompatible with strong bases, strong oxidizing agents.

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H226-H315-H319-H335

GHS Classification：

|Warning|H226 (99.93%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 1573 companies from 8 notifications to the ECHA C&L Inventory.

trans-2-Hexenyl acetate Use and Manufacturing

Methods of Manufacturing

It is formed by esterification of trans-2-vinyl alcohol and acetic acid.

Uses

GB 2760-1996 allows the use of food flavors.

Manufacturing Info：

2-Hexen-1-ol, 1-acetate, (2E)-: ACTIVE

Use Classification：

Food additives -> Flavoring Agents|Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:142.20
XLogP3:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:142.099379685
Monoisotopic Mass:142.099379685
Topological Polar Surface Area:26.3
Heavy Atom Count:10
Complexity:116
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of trans-2-Hexenyl acetate

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
Learn More Other Chemicals

trans-2-Hexenyl acetate

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