2-Phenylpropyl acetate

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Names

[ CAS No. ]:
10402-52-5

[ Name ]:
2-Phenylpropyl acetate

[Synonym ]:
Hydratropyl acetate
EINECS 233-871-2
2-phenyl-1-propyl acetate
Hydratropic acetate

Chemical & Physical Properties

[ Density]:
1.012 g/cm3

[ Boiling Point ]:
240ºC at 760 mmHg

[ Molecular Formula ]:
C11H14O2

[ Molecular Weight ]:
178.22800

[ Flash Point ]:
99.1ºC

[ Exact Mass ]:
178.09900

[ PSA ]:
26.30000

[ LogP ]:
2.35320

[ Vapour Pressure ]:
0.0389mmHg at 25°C

[ Index of Refraction ]:
1.496

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SG8600000
CHEMICAL NAME :
Phenethyl alcohol, beta-methyl-, acetate
CAS REGISTRY NUMBER :
10402-52-5
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C11-H14-O2
MOLECULAR WEIGHT :
178.25
WISWESSER LINE NOTATION :
1YR&1OV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,797,1976 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
4300 mg/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: 14,797,1976

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2-Phenyl-1-propanol
  • Ethanoic anhydride
  • acetic acid
  • vinyl acetate
  • 2-phenylpropionaldehyde
  • methyl 2-phenylpropionate
  • Acetyl chloride
  • (E)-2-phenyl-1(2)-propene-1-yl acetate
  • Cumene
  • lead tetraacetate

DownStream

  • (S)-(-)-2-PHENYL-1-PROPANOL
  • 2-Phenyl-1-propanol
  • 1-[4-(1-hydroxypropan-2-yl)phenyl]ethanone

Related Compounds

  • 2-phenylpropyl acetate
  • 2-phenylpropyl acetate
  • 2-Methyl-2-phenylpropyl acetate
  • 2-hydroxy-2-phenylpropyl acetate
  • 2-chloro-1-cyano-2-phenylpropyl acetate
  • Acetyltropylic chloride
  • N-[4-chloro-3-(trifluoromethyl)phenyl]-3-(3-hydroxyphenyl)propanamide
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-(4,5,6-trifluoro-1H-indol-3-yl)ethanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine