Basic information
- Standard SMILES
FC(F)(F)c1ccc(Sc2ccc(Cl)cc2)c(Br)c1- InChIKey
BYDWHSLCSYNLPK-UHFFFAOYSA-N- Molecular formula
- C13H7BrClF3S
- Average molar mass
- 367.61 g/mol
Names & identifiers
- Preferred name
- 1-Bromo-2-(4-chlorophenylsulfanyl)-5-(trifluoromethyl)benzene
- IUPAC
- 2-bromo-1-(4-chlorophenyl)sulfanyl-4-(trifluoromethyl)benzene
Names & synonyms
1-bromo-2-(4-chlorophenylsulfanyl)-5-(trifluoromethyl)benzeneSCHEMBL35429521-bromo-2-(4-chloro-phenylsulfanyl)-5-(trifluoromethyl)-benzene
Database identifiers
- PubChem CID
- 68683413
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 292
Related reactions
6 records
Linked notes
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