2-phenylethyl propanoate

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Names

[ CAS No. ]:
122-70-3

[ Name ]:
2-phenylethyl propanoate

[Synonym ]:
Propanoic acid, 2-phenylethyl ester
2-phenylethyl propanoate
Phenethyl Propionate
Propionic Acid Phenethyl Ester
MFCD00027008
Phenylethanol propanoate
EINECS 203-013-1
Propionic Acid 2-Phenylethyl Ester
2-Phenylethyl propionate
Propionic acid, 2-phenylethyl ester

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
251.9±9.0 °C at 760 mmHg

[ Molecular Formula ]:
C11H14O2

[ Molecular Weight ]:
178.228

[ Flash Point ]:
107.4±17.1 °C

[ Exact Mass ]:
178.099380

[ PSA ]:
26.30000

[ LogP ]:
2.83

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.499

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UF6488000
CHEMICAL NAME :
Propionic acid, phenethyl ester
CAS REGISTRY NUMBER :
122-70-3
BEILSTEIN REFERENCE NO. :
2097455
LAST UPDATED :
199701
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C11-H14-O2
MOLECULAR WEIGHT :
178.25
WISWESSER LINE NOTATION :
2VO2R

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
4 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 12,963,1974
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 :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 12,963,1974 *** U.S. STANDARDS AND REGULATIONS *** EPA FIFRA 1988 PESTICIDE SUBJECT TO REGISTRATION OR RE-REGISTRATION FEREAC Federal Register. (U.S. Government Printing Office, Supt. of Documents, Washington, DC 20402) V.1- 1936- Volume(issue)/page/year: 54,7740,1989

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)

[ Hazard Codes ]:
Xi: Irritant;

[ Risk Phrases ]:
R36/38

[ Safety Phrases ]:
S26-S36

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
AJ3255000

[ HS Code ]:
2915509000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Phenethyl alcohol
  • Propionic anhydride
  • (2-Bromoethyl)benzene
  • Propionaldehyde
  • 1-Oxopropylphosphonic acid diethyl ester
  • benzene

DownStream

  • Methyl propanoate
  • Phenethyl alcohol

Customs

[ HS Code ]: 2915509000

[ Summary ]:
2915509000 propionic acid, its salts and esters。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:5.5%。general tariff:30.0%

Related Compounds

  • 2-methoxy-4-prop-2-enylphenol,2-phenylethyl propanoate
  • 2-phenylethyl 3-(4'-methoxyphenyl)propanoate
  • 2-phenylethyl 3-(aziridin-1-yl)propanoate
  • 2-phenylethyl 2-(11-oxo-6a,7,8,9,10,10a-hexahydro-6H-benzo[c][1]benzothiepin-3-yl)propanoate
  • 2-phenylethyl N-bromo-N-methylcarbamate
  • 2-phenylethyl N-methylcarbamate
  • 1-[6-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-N,4-dimethylhexanamido]cyclopropane-1-carboxylic acid
  • 1-{2-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-1,3-thiazol-4-yl]-N-methylacetamido}cyclopropane-1-carboxylic acid
  • 1-[N-methyl4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylbenzamido]cyclopropane-1-carboxylic acid
  • 1-{N-methyl2-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]cyclohexaneamido}cyclopropane-1-carboxylic acid
  • 4-{[2-(1-benzylpyrrolidin-3-yl)ethyl]carbamoyl}-4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoic acid
  • 4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-[(2-methoxycyclobutyl)carbamoyl]butanoic acid
  • rac-(1R,3S)-3-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-methoxybutanamido]cyclohexane-1-carboxylic acid
  • rac-(1R,3S)-3-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclopent-1-ene-1-amido]cyclohexane-1-carboxylic acid
  • (1RS,3SR)-3-[(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanamido]cyclohexane-1-carboxylic acid
  • rac-(1R,3S)-3-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methylbutanamido]cyclohexane-1-carboxylic acid
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