Basic information
- Standard SMILES
C[C@H](C(=O)O)c1ccc(Cl)c(Cl)c1- InChIKey
JSAPFNPRLYFXQD-YFKPBYRVSA-N- Molecular formula
- C9H8Cl2O2
- Average molar mass
- 219.06 g/mol
Names & identifiers
- Preferred name
- (S)-2-(3,4-dichlorophenyl)propanoic acid
- IUPAC
- (2S)-2-(3,4-dichlorophenyl)propanoic acid
Names & synonyms
SCHEMBL1590709JSAPFNPRLYFXQD-YFKPBYRVSA-N(S)-2-(3,4-dichlorophenyl)propanoic acid
Database identifiers
- PubChem CID
- 28292773
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 196
Related reactions
1 records
Compound notes
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