Basic information
- Standard SMILES
CS(=O)(=O)Nc1ccc(C#N)c(Cl)c1- InChIKey
SFGGYLRBEPTSDS-UHFFFAOYSA-N- Molecular formula
- C8H7ClN2O2S
- Average molar mass
- 230.67 g/mol
- Monoisotopic mass
- 229.9916763
Names & identifiers
- Preferred name
- N-(3-chloro-4-cyanophenyl)methanesulfonamide
- IUPAC
- N-(3-chloro-4-cyanophenyl)methanesulfonamide
Names & synonyms
N-(3-chloro-4-cyanophenyl)methanesulfonamide53313-04-5N-(3-Chloro-4-cyano-phenyl)-methanesulfonamideOprea1_716919SCHEMBL2678340SFGGYLRBEPTSDS-UHFFFAOYSA-NMFCD01601850STK088098AKOS002376689DA-05148ST043437N-(3-Chloro-4-cyanophenyl)-methanesulfonamide
Show more names
AB00682620-01SR-01000062974SR-01000062974-12-chloro-4-[(methylsulfonyl)amino]benzenecarbonitrileN-(3-Chloro-4-cyano-phenyl)-methanesulfonamide, 95%Z45564035
Database identifiers
- PubChem CID
- 669685
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 78.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 340
Related reactions
8 records
Compound notes
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