2-Benzyl-3-phenylprop-2-enoic acid
Basic information
- CAS
4361-83-5- Standard SMILES
O=C(O)C(=Cc1ccccc1)Cc1ccccc1- InChIKey
KNEFRHCUYCDKRK-UHFFFAOYSA-N- Molecular formula
- C16H14O2
- Average molar mass
- 238.28 g/mol
- Monoisotopic mass
- 238.09937969
Names & identifiers
- Preferred name
- 2-Benzyl-3-phenylprop-2-enoic acid
- IUPAC
- 2-benzyl-3-phenylprop-2-enoic acid
Names & synonyms
4361-83-52-benzyl-3-phenylprop-2-enoic acidNSC26079MLS0026390912-benzyl-3-phenylacrylic acidbenzylcinnamic acidNCIStruc1_000370NCIStruc2_000403SCHEMBL58024benzyl-3-phenylpropenoic acidCHEMBL1892305DTXSID40282484
Show more names
KNEFRHCUYCDKRK-UHFFFAOYSA-NHMS3080E032-Benzyl-3-phenyl-prop-2-enoic acidNCI60_002083SMR001548542DS-012992
Database identifiers
- CAS
4361-83-5- PubChem CID
- 230795
- DTXSID
DTXSID40282484- ChEMBL
CHEMBL1892305
Properties
Computed structural properties
- XLogP
- 2.9
- 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
- 294
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…