3-Methylbutyl phenylacetate

Modify Date: 2025-08-21 19:03:41

3-Methylbutyl phenylacetate Structure
3-Methylbutyl phenylacetate structure
 Common Name 3-Methylbutyl phenylacetate
CAS Number 102-19-2 Molecular Weight 206.281
Density 1.0±0.1 g/cm3 Boiling Point 274.8±9.0 °C at 760 mmHg
Molecular Formula C13H18O2 Melting Point N/A
MSDS Chinese USA Flash Point 103.2±17.1 °C
Symbol GHS07
GHS07		 Signal Word Warning

 Names

Name Phenylacetic Acid Isoamyl Ester
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.0±0.1 g/cm3
Boiling Point 274.8±9.0 °C at 760 mmHg
Molecular Formula C13H18O2
Molecular Weight 206.281
Flash Point 103.2±17.1 °C
Exact Mass 206.130676
PSA 26.30000
LogP 3.91
Vapour Pressure 0.0±0.6 mmHg at 25°C
Index of Refraction 1.494

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AJ2945000
CHEMICAL NAME :
Acetic acid, phenyl-, isopentyl ester
CAS REGISTRY NUMBER :
102-19-2
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C13-H18-O2
MOLECULAR WEIGHT :
206.31
WISWESSER LINE NOTATION :
1Y12OV1R

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit

MUTATION DATA

TYPE OF TEST :
Gene conversion and mitotic recombination
TEST SYSTEM :
Bacteria - Bacillus subtilis
DOSE/DURATION :
20 ug/disc
REFERENCE :
OEKSDJ Osaka-furitsu Koshu Eisei Kenkyusho Kenkyu Hokoku, Shokuhin Eisei Hen. Research Reports of the Osaka Prefectural Institute of Public Health, Food Sanitation Section. (Osaka-furitsu Koshu Eisei Kenkyusho, 1-3-69 Nakamichi, Higashinari-ku, Osaka 537, Japan) No.1- 1970- Volume(issue)/page/year: 9,177,1978

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315
Hazard Codes Xi: Irritant;
Risk Phrases 38
Safety Phrases S26-S36
RIDADR NONH for all modes of transport
WGK Germany 2
RTECS AJ2945000
HS Code 2942000000

 Synthetic Route

Phenylacetic acid structure

Phenylacetic acid

CAS#:103-82-2

3-Methyl-1-butanol structure

3-Methyl-1-butanol

CAS#:123-51-3

~92%

3-Methylbutyl phenylacetate Structure

3-Methylbutyl p...

CAS#:102-19-2

Literature: Gumaste, Vikas K.; Deshmukh; Bhawal Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1996 , vol. 35, # 11 p. 1174 - 1179
Phenylacetic acid structure

Phenylacetic acid

CAS#:103-82-2

~77%

3-Methylbutyl phenylacetate Structure

3-Methylbutyl p...

CAS#:102-19-2

Literature: Parmar, Anupama; Kaur, Jatinder; Goyal, Rita; Kumar, Baldev; Kumar, Harish Synthetic Communications, 1998 , vol. 28, # 15 p. 2821 - 2826
3-Methyl-1-butanol structure

3-Methyl-1-butanol

CAS#:123-51-3

Methyl 2-phenylacetate structure

Methyl 2-phenyl...

CAS#:101-41-7

~%

3-Methylbutyl phenylacetate Structure

3-Methylbutyl p...

CAS#:102-19-2

Literature: Synthesis, , # 2 p. 112 - 114

 Customs

HS Code 2916399090
Summary 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

3-Methylbutyl phenylacetate
Isopentyl 2-phenylacetate
MFCD00026517
Isopentyl phenylacetate
3-methylbutyl 2-phenylacetate
Isoamyl phenylacetate
Benzeneacetic acid, 3-methylbutyl ester
EINECS 203-012-6
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