Basic information
- Standard SMILES
O=C(O)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1- InChIKey
ZHVCKMSAEWCLOO-JTQLQIEISA-N- Molecular formula
- C12H11Cl2NO3
- Average molar mass
- 288.12 g/mol
Names & identifiers
- Preferred name
- N-(3,4-dichlorobenzoyl)proline
- IUPAC
- (2S)-1-(3,4-dichlorobenzoyl)pyrrolidine-2-carboxylic acid
Names & synonyms
N-(3,4-dichlorobenzoyl)prolineSCHEMBL10658082ZHVCKMSAEWCLOO-JTQLQIEISA-NAKOS026859423
Database identifiers
- PubChem CID
- 822734
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 350
Related reactions
2 records
Compound notes
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