Ethyl trans-caffeate

CAS Registry Number®

66648-50-8

CAS Name

Ethyl trans-caffeate

Molecular Formula

C11H12O4

Molecular Mass

208.21

Cite this Page

Ethyl trans-caffeate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=66648-50-8 (retrieved 2024-11-21) (CAS RN: 66648-50-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    148-149 °C

  • Melting Point (2)

    147-148 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H12O4/c1-2-15-11(14)6-4-8-3-5-9(12)10(13)7-8/h3-7,12-13H,2H2,1H3/b6-4+

InChIKey

InChIKey=WDKYDMULARNCIS-GQCTYLIASA-N

SMILES

C(=C/C(OCC)=O)\C1=CC(O)=C(O)C=C1

Canonical SMILES

O=C(OCC)C=CC1=CC=C(O)C(O)=C1

Other Names for this Substance

  • 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, ethyl ester, (2E)-
  • 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, ethyl ester, (E)-
  • Ethyl trans-caffeate
  • trans-Caffeic acid ethyl ester
  • trans-Caffeoyl ethyl ester

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration