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Substance Name: Caffeic acid phenethyl ester
RN: 104594-70-9
UNII: G960R9S5SK
InChIKey: SWUARLUWKZWEBQ-VQHVLOKHSA-N

Molecular Formula

  • C17-H16-O4

Molecular Weight

  • 284.309
 
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Names and Synonyms

Name of Substance

  • Caffeic acid phenethyl ester

Synonyms

  • 2-phenylethyl 3-(3,4-dihydroxyphenyl)-2-propenoate
  • Caffeic acid phenethyl ester
  • Capeee
  • Phenethyl caffeate
  • UNII-G960R9S5SK

Systematic Name

  • 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, 2-phenylethyl ester

Registry Numbers

CAS Registry Number

  • 104594-70-9

FDA UNII

  • G960R9S5SK

System Generated Number

  • 0104594709

Structure Descriptors

InChI

1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-7+

InChIKey

SWUARLUWKZWEBQ-VQHVLOKHSA-N

Smiles

c1(c(cc(cc1)\C=C\C(OCCc1ccccc1)=O)O)O