Pyridine, 2-[[(2-chlorophenyl)methyl]sulfonyl]-, 1-oxide
Basic information
- CAS
60264-12-2- Standard SMILES
O=S(=O)(Cc1ccccc1Cl)c1cccc[n+]1[O-]- InChIKey
UGESEDUIFVAGHR-UHFFFAOYSA-N- Molecular formula
- C12H10ClNO3S
- Average molar mass
- 283.73 g/mol
- Monoisotopic mass
- 283.006992
Names & identifiers
- Preferred name
- Pyridine, 2-[[(2-chlorophenyl)methyl]sulfonyl]-, 1-oxide
- IUPAC
- 2-[(2-chlorophenyl)methylsulfonyl]-1-oxidopyridin-1-ium
Names & synonyms
60264-12-2Pyridine, 2-[[(2-chlorophenyl)methyl]sulfonyl]-, 1-oxideCHEMBL144941SCHEMBL11840509DTXSID203333672-(2-Chloro-phenylmethanesulfonyl)-pyridine, 1-oxide2-[(2-chlorophenyl)methylsulfonyl]-1-oxido-pyridin-1-ium2-[(2-Chlorophenyl)methanesulfonyl]-1-oxo-1lambda~5~-pyridine
Database identifiers
- CAS
60264-12-2- PubChem CID
- 501101
- DTXSID
DTXSID20333367- ChEMBL
CHEMBL144941
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 68 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 368
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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