N-(3-methylphenyl)ethanesulfonamide

HCID 767451

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Basic information

CAS: 60901-24-8
Standard SMILES: CCS(=O)(=O)Nc1cccc(C)c1
InChIKey: BRPFPNKQXVZICW-UHFFFAOYSA-N
Molecular formula: C9H13NO2S
Average molar mass: 199.27 g/mol
Monoisotopic mass: 199.06669983

Names & identifiers

Preferred name: N-(3-methylphenyl)ethanesulfonamide
IUPAC: N-(3-methylphenyl)ethanesulfonamide

Names & synonyms

N-(3-methylphenyl)ethanesulfonamide60901-24-8Ethanesulfonamide, N-(3-methylphenyl)-SCHEMBL7975302SCHEMBL10191952DTXSID90354266AKOS001592134AE-848/36287059SR-01000398129SR-01000398129-1

Database identifiers

CAS: 60901-24-8
PubChem CID: 767451
DTXSID: DTXSID90354266

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 54.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 13
Formal charge: 0
Complexity: 243

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