Basic information
- Standard SMILES
Cc1c(-c2ccccc2)sc2ccc(Cl)cc12- InChIKey
MXKUVSBIGQHGEA-UHFFFAOYSA-N- Molecular formula
- C15H11ClS
- Average molar mass
- 258.8 g/mol
Names & identifiers
- Preferred name
- 5-Chloro-3-methyl-2-phenyl-1-benzothiophene
- IUPAC
- 5-chloro-3-methyl-2-phenyl-1-benzothiophene
Names & synonyms
5-chloro-3-methyl-2-phenyl-1-benzothiophene51828-63-8SCHEMBL6076483MXKUVSBIGQHGEA-UHFFFAOYSA-N5-chloro-3-methyl-2-phenylbenzo[b]thiopheneAA-516/33241040
Database identifiers
- PubChem CID
- 821982
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 262
Related reactions
7 records
Compound notes
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