Basic information
- Standard SMILES
O=Cc1cn(-c2ccc(Cl)cc2)cn1- InChIKey
VLQKBZDJSBEWLN-UHFFFAOYSA-N- Molecular formula
- C10H7ClN2O
- Average molar mass
- 206.63 g/mol
- Monoisotopic mass
- 206.0246905
Names & identifiers
- Preferred name
- 1-(4-chlorophenyl)-1H-imidazole-4-carbaldehyde
- IUPAC
- 1-(4-chlorophenyl)imidazole-4-carbaldehyde
Names & synonyms
1-(4-chlorophenyl)-1H-imidazole-4-carbaldehydeSCHEMBL16043335TQP1182VLQKBZDJSBEWLN-UHFFFAOYSA-NDB-09267571164-81-3
Database identifiers
- PubChem CID
- 83883034
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 204
Related reactions
3 records
Linked notes
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