(E)-2,4-diphenylbut-3-enoic acid
Basic information
- CAS
2294-90-8- Standard SMILES
O=C(O)C(/C=C/c1ccccc1)c1ccccc1- InChIKey
XDCWKTVDGLXVME-VAWYXSNFSA-N- Molecular formula
- C16H14O2
- Average molar mass
- 238.28 g/mol
- Monoisotopic mass
- 238.09937969
Names & identifiers
- Preferred name
- (E)-2,4-diphenylbut-3-enoic acid
- IUPAC
- (E)-2,4-diphenylbut-3-enoic acid
Names & synonyms
NSC154652NSC-154652CHEMBL2006533
Database identifiers
- CAS
2294-90-8- PubChem CID
- 5458329
- ChEMBL
CHEMBL2006533
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 283
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Compound notes
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