Basic information
- Standard SMILES
Cc1ccc(S(=O)(=O)C(C)C)cc1Cl- InChIKey
VOFHSDZOALCLMY-UHFFFAOYSA-N- Molecular formula
- C10H13ClO2S
- Average molar mass
- 232.73 g/mol
- Monoisotopic mass
- 232.0324785
Names & identifiers
- Preferred name
- 3-Chloro-4-methylphenyl isopropyl sulfone
- IUPAC
- 2-chloro-1-methyl-4-propan-2-ylsulfonylbenzene
Names & synonyms
SCHEMBL1755240VOFHSDZOALCLMY-UHFFFAOYSA-N3-chloro-4-methylphenyl isopropyl sulfone
Database identifiers
- PubChem CID
- 19738652
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 279
Related reactions
2 records
Compound notes
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