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2-Propen-1-yl (2E,4E)-2,4-hexadienoate

2-Propen-1-yl (2E,4E)-2,4-hexadienoate structure

CAS No:
7493-75-6
Formula:
C9H12O2
Chemical Name:
2-Propen-1-yl (2E,4E)-2,4-hexadienoate
Synonyms:
2,4-Hexadienoic acid,2-propen-1-yl ester,(2E,4E)-;Sorbic acid,allyl ester;2,4-Hexadienoic acid,2-propenyl ester,(E,E)-;2,4-Hexadienoic acid,2-propenyl ester,(2E,4E)-;2-Propen-1-yl (2E,4E)-2,4-hexadienoate;Allyl 2,4-hexadienoate;Allyl sorbate
Categories:
Flavors and Fragrances > Synthetic Fragrances

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Description

Allyl sorbate is a colorless liquid with a fruital pineapple-like odor.

Colourless to light yellow liquid with a fruital pineapple-like odour

2-Propenyl 2,4-hexadienoate is a fatty acid ester.

2-Propen-1-yl (2E,4E)-2,4-hexadienoate Basic Attributes

Molecular Weight：

152.19

Exact Mass：

152.19

EC Number：

231-336-8

UNII：

437U27070O

HScode：

2916190090

Characteristics

PSA：

26.30000

XLogP3：

1.84790

Appearance：

Colourless to light yellow liquid with a fruital pineapple-like odour

Density：

0.934 g/cm3

Melting Point：

124-127 °C @ Solvent: Ethanol

Boiling Point：

208.7ºC at 760 mmHg

Flash Point：

92.7ºC

Refractive Index：

1.506

Water Solubility：

Soluble in ethanol

Safety Information

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

2-Propen-1-yl (2E,4E)-2,4-hexadienoate Use and Manufacturing

Uses

Spices for food.

Manufacturing Info：

2,4-Hexadienoic acid, 2-propen-1-yl ester, (2E,4E)-: INACTIVE

Use Classification：

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]

Food Additive Classes：

Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT;

Computed Properties

Molecular Weight:152.19
XLogP3:2.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:152.083729621
Monoisotopic Mass:152.083729621
Topological Polar Surface Area:26.3
Heavy Atom Count:11
Complexity:178
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Propen-1-yl (2E,4E)-2,4-hexadienoate

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

2-Propen-1-yl (2E,4E)-2,4-hexadienoate

SDS

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