Basic information
- Standard SMILES
C=C(C(=O)OC)[C@@H](O)c1ccccc1- InChIKey
VZGOKIHNKHAORQ-SNVBAGLBSA-N- Molecular formula
- C11H12O3
- Average molar mass
- 192.21 g/mol
Names & identifiers
- Preferred name
- (+)Methyl 3(S)-hydroxy-2-methylene-3-phenylpropanoate
- IUPAC
- methyl 2-[(S)-hydroxy(phenyl)methyl]prop-2-enoate
Names & synonyms
SCHEMBL13204521VZGOKIHNKHAORQ-SNVBAGLBSA-N(+)Methyl 3(S)-hydroxy-2-methylene-3-phenylpropanoate
Database identifiers
- PubChem CID
- 11008751
- Nikkaji
- J580.256C
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 217
Related reactions
2 records
Compound notes
Loading…