102-19-2

102-19-2 structure

Name: 3-Methylbutyl phenylacetate
Chemical Name: Phenylacetic Acid Isoamyl Ester
CAS Number: 102-19-2
Molecular Formula: C₁₃H₁₈O₂
Molecular Weight: 206.281
Catalog: Flavors and spices Synthetic spice Carboxylic acid and ester perfume Aromatic carboxylic acid ester
Create Date: 2018-04-15 08:00:00
Modify Date: 2024-01-04 17:33:45

Name	Phenylacetic Acid Isoamyl Ester
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

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

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

Symbol	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

103-82-2

123-51-3

~92%

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

103-82-2

~77%

102-19-2

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

123-51-3

101-41-7

102-19-2

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

Precursor 3
103-82-2 123-51-3 101-41-7
DownStream 0

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%

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