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Home > Encyclopedia > 3-Hexenyl 2-methylbutyrate

3-Hexenyl 2-methylbutyrate

3-Hexenyl 2-methylbutyrate structure

3-Hexenyl 2-methylbutyrate 

structure
  • CAS No:

    10094-41-4

  • Formula:

    C11H20O2

  • Chemical Name:

    3-Hexenyl 2-methylbutyrate

  • Synonyms:

    Butanoic acid,2-methyl-,3-hexen-1-yl ester;Butyric acid,2-methyl-,3-hexenyl ester;Butanoic acid,2-methyl-,3-hexenyl ester;3-Hexenyl 2-methylbutyrate;3-Hexenyl 2-methylbutanoate;2-Methylbutanoic acid 3-hexenyl ester;166734-47-0

  • Categories:

    Cosmetic Ingredient  >  Perfuming

Description

clear, colourless liquid


3-Hexenyl 2-methylbutyrate is a fatty acid ester.

3-Hexenyl 2-methylbutyrate Basic Attributes

184.2753

184.28

233-224-4

Characteristics

26.30000

2.93200

0.887g/cm3

231.8ºC at 760 mmHg

182 °F

1.44

0.0613mmHg at 25°C

Safety Information

UN 3077 9/PG 3

2

51/53

61

N

3-Hexenyl 2-methylbutyrate Use and Manufacturing

Butanoic acid, 2-methyl-, 3-hexen-1-yl ester: ACTIVE

Food additives -> Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT; -> JECFA Functional Classes|Flavoring Agents -> JECFA Flavorings Index|Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]

Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT;

Computed Properties

Molecular Weight:184.27
XLogP3:3.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:184.146329876
Monoisotopic Mass:184.146329876
Topological Polar Surface Area:26.3
Heavy Atom Count:13
Complexity:162
Undefined Atom Stereocenter Count:1
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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