Basic information
- Standard SMILES
O=C(CCl)c1cccc2sccc12- InChIKey
VJHGNQQLDVHFDV-UHFFFAOYSA-N- Molecular formula
- C10H7ClOS
- Average molar mass
- 210.68 g/mol
Names & identifiers
- Preferred name
- 1-(Benzo[b]thiophen-4-yl)-2-chloroethan-1-one
- IUPAC
- 1-(1-benzothiophen-4-yl)-2-chloroethanone
Names & synonyms
SCHEMBL6327807VJHGNQQLDVHFDV-UHFFFAOYSA-N1-(benzo[b]thiophen-4-yl)-2-chloroethan-1-one
Database identifiers
- PubChem CID
- 22473799
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 207
Related reactions
3 records
Compound notes
Loading…