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Substance Name: 3-Phenylpropyl cinnamate
RN: 122-68-9
InChIKey: LYRAHIUDQRJGGZ-UHFFFAOYSA-N

Molecular Formula

  • C18-H18-O2

Molecular Weight

  • 266.3382
 
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Names and Synonyms

Synonyms

  • 2-Propenoic acid, 3-phenyl-, 3-phenylpropyl ester
  • 3-Phenyl-2-propenoic acid 3-phenylpropyl ester
  • 3-Phenylpropyl 3-phenyl-2-propenoate
  • 3-Phenylpropyl beta-phenylacrylate
  • 3-Phenylpropyl cinnamate
  • Cinnamic acid, 3-phenylpropyl ester
  • EINECS 204-565-6
  • FEMA No. 2894
  • Hydrocinnamyl 3-phenylpropenoate
  • Hydrocinnamyl cinnamate
  • Phenylpropyl cinnamate

Systematic Names

  • 2-Propenoic acid, 3-phenyl-, 3-phenylpropyl ester
  • 3-Phenylpropyl cinnamate
  • Cinnamic acid, 3-phenylpropyl ester (7CI,8CI)

Superlist Name

  • 3-Phenylpropyl cinnamate

Registry Numbers

CAS Registry Number

  • 122-68-9

System Generated Number

  • 0000122689

Structure Descriptors

InChI

1S/C18H18O2/c19-18(14-13-17-10-5-2-6-11-17)20-15-7-12-16-8-3-1-4-9-16/h1-6,8-11,13-14H,7,12,15H2

InChIKey

LYRAHIUDQRJGGZ-UHFFFAOYSA-N

Smiles

O=C(OCCCc1ccccc1)C=Cc2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 12, Pg. 969, 1974.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 12, Pg. 969, 1974.