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Substance Name: Phenethyl cinnamate
RN: 103-53-7
InChIKey: MJQVZIANGRDJBT-VAWYXSNFSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C17-H16-O2

Molecular Weight

  • 252.311
 
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Names and Synonyms

Synonyms

  • 2-Phenylethyl 3-phenylpropenoate
  • 2-Phenylethyl cinnamate
  • 2-Propenoic acid, 3-phenyl-, 2-phenylethyl ester
  • AI3-01026
  • Benzylcarbinyl 3-phenylpropenoate
  • Benzylcarbinyl cinnamate
  • beta-Phenethyl beta-phenylacrylate
  • Cinnamic acid, phenethyl ester
  • EINECS 203-120-3
  • FEMA No. 2863
  • NSC 16962
  • Phenethyl cinnamate
  • Phenylethyl cinnamate

Systematic Names

  • 2-Propenoic acid, 3-phenyl-, 2-phenylethyl ester
  • Cinnamic acid, phenethyl ester
  • Phenethyl cinnamate

Superlist Name

  • Phenethyl cinnamate

Registry Numbers

CAS Registry Number

  • 103-53-7

System Generated Number

  • 0000103537

Structure Descriptors

InChI

1S/C17H16O2/c18-17(12-11-15-7-3-1-4-8-15)19-14-13-16-9-5-2-6-10-16/h1-12H,13-14H2/b12-11+

InChIKey

MJQVZIANGRDJBT-VAWYXSNFSA-N

Smiles

c1(\C=C\C(OCCc2ccccc2)=O)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 4500mg/kg (4500mg/kg)   Food and Cosmetics Toxicology. Vol. 16, Pg. 845, 1978.
mouse LD50 oral 4500mg/kg (4500mg/kg)   Food and Cosmetics Toxicology. Vol. 16, Pg. 845, 1978.
rat LD50 oral 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 16, Pg. 845, 1978.