Basic information
- Standard SMILES
O=C(O)CC/C=C/CCc1ccccc1- InChIKey
JSPSYZDWNHBEEX-OWOJBTEDSA-N- Molecular formula
- C13H16O2
- Average molar mass
- 204.26 g/mol
Names & identifiers
- Preferred name
- E-7-Phenylhept-4-enoic acid
- IUPAC
- (E)-7-phenylhept-4-enoic acid
Names & synonyms
E-7-Phenylhept-4-enoic acidSCHEMBL6758432JSPSYZDWNHBEEX-OWOJBTEDSA-N
Database identifiers
- PubChem CID
- 9899164
- Nikkaji
- J2.137.122J
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 203
Related reactions
9 records
Compound notes
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