Basic information
- Standard SMILES
O=Cc1c(-c2ccc(Cl)cc2)sc2ccccc12- InChIKey
HIRIYMQFSWAGQA-UHFFFAOYSA-N- Molecular formula
- C15H9ClOS
- Average molar mass
- 272.7 g/mol
Names & identifiers
- Preferred name
- 2-(4-Chlorophenyl)benzo[b]thiophene-3-carbaldehyde
- IUPAC
- 2-(4-chlorophenyl)-1-benzothiophene-3-carbaldehyde
Names & synonyms
CHEMBL394375SCHEMBL1347570HIRIYMQFSWAGQA-UHFFFAOYSA-N2-(4-chlorophenyl)benzo[b]thiophene-3-carbaldehyde
Database identifiers
- PubChem CID
- 11623195
- ChEMBL
CHEMBL394375
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 301
Related reactions
1 records
Compound notes
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