Structure via PubChem · Public domain (PubChem)
caffeic acid phenethyl ester
Sign in to saveAlso known as CAPE, 2-phenylethyl caffeate, phenethyl caffeate, 2-phenylethyl (2E)-3-(3,4-dihydroxyphenyl)acrylate, (E)-caffeic acid phenethyl ester
chemical compound
Chemical data
- Formula
- C17H16O4
- Molecular weight
- 284.31 g/mol
- IUPAC name
- 2-phenylethyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
- SMILES
- C1=CC=C(C=C1)CCOC(=O)/C=C/C2=CC(=C(C=C2)O)O
- InChIKey
- SWUARLUWKZWEBQ-VQHVLOKHSA-N
- XLogP
- 4.2
- Polar surface area
- 66.8 Ų
- H-bond donors
- 2
- H-bond acceptors
- 4
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Mass
- 284.105
Show 4 more facts
- found in taxon
- Populus szechuanica
- chemical formula
- C₁₇H₁₆O₄
- isomeric SMILES
- C1=CC=C(C=C1)CCOC(=O)/C=C/C2=CC(=C(C=C2)O)O
- canonical SMILES
- C1=CC=C(C=C1)CCOC(=O)C=CC2=CC(=C(C=C2)O)O
via Wikidata · CC0