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Isoamyl phenylacetate

Isoamyl phenylacetate structure

CAS No:
102-19-2
Formula:
C13H18O2
Chemical Name:
Isoamyl phenylacetate
Synonyms:
Benzeneacetic acid,3-methylbutyl ester;Acetic acid,phenyl-,isopentyl ester;Isopentyl alcohol,phenylacetate;Isoamyl phenylacetate;Isopentyl phenylacetate;Phenylacetic acid,isopentyl ester;NSC 60582;3-Methylbutyl phenylacetate;3-Methylbutyl 2-phenylacetate
Categories:
Cosmetic Ingredient > Perfuming

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Description

Colourless liquid; sweet musky animal odour with fruity balsamic undertone reminiscent of fresh cocoa beans

Isoamyl phenylacetate Basic Attributes

Molecular Weight：

206.28

Exact Mass：

206.28

EC Number：

203-012-6

UNII：

E5RHQ50DDC

NSC Number：

60582

DSSTox ID：

DTXSID2044501

HScode：

2916399090

Characteristics

PSA：

26.3

XLogP3：

3.91

Appearance：

Colourless liquid; sweet musky animal odour with fruity balsamic undertone reminiscent of fresh cocoa beans

Density：

0.9267 g/cm³ @ Temp: 16 °C

Boiling Point：

250-251 °C

Flash Point：

>230 °F

Refractive Index：

1.494

Water Solubility：

Insoluble in water; soluble in oils

Vapor Pressure：

0.00528mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

safety instructions：

26-36

RTECS Number：

AJ2945000

Marks：

Precautionary statement(s)：

P264, P280, P302+P352, P321, P332+P313, P362

Hazard Statements：

H315

GHS Classification：

Not Classified

Isoamyl phenylacetate Use and Manufacturing

Methods of Manufacturing

By the esterification of phenylacetic acid and isoamyl alcohol in the presence of dry hydrogen chloride gas or sulfuric acid.

Uses

Ester synthetic fragrance.

Manufacturing Info：

Benzeneacetic acid, 3-methylbutyl ester: ACTIVE

Use Classification：

Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:206.28
XLogP3:3.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:206.130679813
Monoisotopic Mass:206.130679813
Topological Polar Surface Area:26.3
Heavy Atom Count:15
Complexity:181
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Methyl phenylacetate

Isoamyl alcohol

Hydrogen

Learn More Other Chemicals

4-(8,9-dibromo-3,5-dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-4-yl)phenyl phenylacetate

488786-48-7
Hexyl phenylacetate

5421-17-0
Isoamyl octanoate

2035-99-6
Isoamyl lactate Formula

19329-89-6
ETHYL ISOAMYL SULFIDE Formula

66481-77-4
Isobutyl phenylacetate Formula

102-13-6
Methyl phenylacetate Structure

101-41-7
Isoamyl isobutyrate Structure

2050-01-3
What is Ethyl phenylacetate

101-97-3
What is Isoamyl gallate

2486-02-4

Hot Searches: 1 pentanol; so3 sulfur trioxide; aluminum polyphosphate; chlorous acid formula; echemi; gluconic acid

Guide of Isoamyl phenylacetate

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

Isoamyl phenylacetate

SDS

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