(E)-Caffeic acid phenethyl ester

CAS Registry Number®

115610-29-2

CAS Name

(E)-Caffeic acid phenethyl ester

Molecular Formula

C17H16O4

Molecular Mass

284.31

Cite this Page

(E)-Caffeic acid phenethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=115610-29-2 (retrieved 2024-11-21) (CAS RN: 115610-29-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    121-123 °C

Source(s)

Other Names and Identifiers

InChI

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

InChIKey=SWUARLUWKZWEBQ-VQHVLOKHSA-N

SMILES

C(=C/C(OCCC1=CC=CC=C1)=O)\C2=CC(O)=C(O)C=C2

Canonical SMILES

O=C(OCCC=1C=CC=CC1)C=CC2=CC=C(O)C(O)=C2

Other Names for this Substance

  • 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, 2-phenylethyl ester, (2E)-
  • 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, 2-phenylethyl ester, (E)-
  • (E)-Caffeic acid phenethyl ester
  • Phenethyl (E)-caffeate

Deleted or Replaced CAS Registry Numbers

1208233-07-1

CAS INSIGHTSTM
Targeted protein degrader structure, illustration