Benzeneethanol, a-methyl-, 1-acetate

Modify Date: 2025-08-21 15:23:15

Benzeneethanol, a-methyl-, 1-acetate Structure
Benzeneethanol, a-methyl-, 1-acetate structure
 Common Name Benzeneethanol, a-methyl-, 1-acetate
CAS Number 2114-33-2 Molecular Weight 178.22800
Density 1.014g/cm3 Boiling Point 245.6ºC at 760mmHg
Molecular Formula C11H14O2 Melting Point N/A
MSDS N/A Flash Point 103ºC

 Names

Name 1-phenylpropan-2-yl acetate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.014g/cm3
Boiling Point 245.6ºC at 760mmHg
Molecular Formula C11H14O2
Molecular Weight 178.22800
Flash Point 103ºC
Exact Mass 178.09900
PSA 26.30000
LogP 2.18070
Vapour Pressure 0.0285mmHg at 25°C
Index of Refraction 1.497
InChIKey LOHDWLZDQXQLJA-UHFFFAOYSA-N
SMILES CC(=O)OC(C)Cc1ccccc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AI9316000
CHEMICAL NAME :
Acetic acid, alpha-methyl-phenethyl ester
CAS REGISTRY NUMBER :
2114-33-2
LAST UPDATED :
199701
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C11-H14-O2
MOLECULAR WEIGHT :
178.25

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,737,1982 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,737,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,737,1982

 Safety Information

HS Code 2915390090

 Customs

HS Code 2915390090
Summary 2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0%

 Synonyms

Methylbenzylcarbinyl acetate
Benzylmethylcarbinyl acetate
2-Acetoxy-1-phenylpropane
1-Phenyl-2-propanol acetate
1-methyl-2-phenylethyl acetate
Acetic Acid 1-Methyl-2-phenylethyl Ester
EINECS 218-314-3
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