Basic information
- Standard SMILES
O=S(=O)(Cc1c(F)ccc(F)c1F)c1ccc(Cl)cc1- InChIKey
AKLOJUDORBTQDI-UHFFFAOYSA-N- Molecular formula
- C13H8ClF3O2S
- Average molar mass
- 320.71 g/mol
Names & identifiers
- Preferred name
- 2-(4-Chloro-benzenesulfonylmethyl)-1,3,4-trifluoro-benzene
- IUPAC
- 2-[(4-chlorophenyl)sulfonylmethyl]-1,3,4-trifluorobenzene
Names & synonyms
SCHEMBL1364668AKLOJUDORBTQDI-UHFFFAOYSA-N2-(4-Chloro-benzenesulfonylmethyl)-1,3,4-trifluoro-benzene
Database identifiers
- PubChem CID
- 58950334
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 418
Related reactions
13 records
Compound notes
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