chempirical

N-Methyl-p-toluenesulfonamide

C8H11NO2SCAS 640-61-9185.24 g/mol

Open in Covalent MOL file
HNSOO
Sulfonamide

Properties

Molecular formula
C8H11NO2S
Molar mass
185.24 g/mol
Exact mass
185.0510 Da
Melting point
78.5 °C
logP
0.90Crippen estimate
Polar surface area
46.2 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
640-61-9
SMILES
CNS(=O)(=O)c1ccc(C)cc1
InChIKey
GWLOGZRVYXAHRE-UHFFFAOYSA-N
InChI
InChI=1S/C8H11NO2S/c1-7-3-5-8(6-4-7)12(10,11)9-2/h3-6,9H,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names
  • Benzenesulfonamide, N,4-dimethyl-
  • p-Toluenesulfonamide, N-methyl-
  • N,4-Dimethylbenzenesulfonamide
  • (p-Tolylsulfonyl)methylamine
  • N-Methyl-p-toluenesulphonamide
  • N-Methyl-4-methylbenzenesulfonamide
  • 4,N-Dimethylbenzenesulfonamide
  • NSC 2223
  • NSC 36991
  • N-Methyl-para-toluenesulfonamide
  • 4-Methyl-N-methylbenzenesulfonamide

Work with N-Methyl-p-toluenesulfonamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Methylbenzenesulfonamide5183-78-863 % similar P-Toluenesulfonylhydrazide1576-35-862 % similar N-Ethyl-4-methylbenzenesulfonamide80-39-760 % similar N-(4-Aminophenyl)-4-methylbenzenesulfonamide6380-08-153 % similar N-Benzyl-p-toluenesulfonamide1576-37-051 % similar Tosylurea1694-06-051 % similar N-Butyl-4-methylbenzenesulfonamide1907-65-951 % similar N-Cyclohexyl-4-toluenesulfonamide80-30-851 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Ethylbenzenesulfonamide138-38-5 Methyl 3-amino-3-(2-thienyl)propanoate188812-40-0 2-Amino-5-ethyl-3-thiophenecarboxylic acid methyl ester19156-63-9 (βS)-β-Amino-3-thiophenebutanoic acid270262-99-2 Ethyl 2-amino-4-methylthiophene-3-carboxylate43088-42-2 2-Amino-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester4651-93-8 Ethyl 2-amino-5-methylthiophene-3-carboxylate4815-32-1 4-Methyl-5-thiazoleethanol acetate656-53-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook