5-Amino-2-methylbenzenesulfonamide

C7H10N2O2SCAS 6973-09-7186.23 g/mol

Open in Covalent MOL file
NH2SH2NOO
Primary amineSulfonamide

Properties

Molecular formula
C7H10N2O2S
Molar mass
186.23 g/mol
Exact mass
186.0463 Da
logP
0.22Crippen estimate
Polar surface area
86.2 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 12 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
6973-09-7
SMILES
Cc1ccc(N)cc1S(N)(=O)=O
InChIKey
KTPBKMYOIFHJMI-UHFFFAOYSA-N
InChI
InChI=1S/C7H10N2O2S/c1-5-2-3-6(8)4-7(5)12(9,10)11/h2-4H,8H2,1H3,(H2,9,10,11)

Weigh it out

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

Names and synonyms

5 names
  • Benzenesulfonamide, 5-amino-2-methyl-
  • 3-Amino-6-methylbenzenesulfonamide
  • NSC 36969
  • 3-Aminosulfonyl-4-methylaniline
  • 2-Methyl-5-amino-benzenesulfonamide

Work with 5-Amino-2-methylbenzenesulfonamide

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

5-Amino-2-methylbenzenesulfonic acid118-88-762 % similar 2-Methylbenzenesulfonamide88-19-756 % similar 2-Methyl-5-nitrobenzene-1-sulfonamide6269-91-654 % similar 5-Amino-2-methyl-N-phenylbenzenesulfonamide79-72-153 % similar 4-Chloro-2,5-dimethylbenzenesulfonamide219689-73-350 % similar 3,4-Xylidine95-64-750 % similar 4-Fluoro-2-methylbenzenesulfonamide489-17-849 % similar Sulfanilamide63-74-147 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-(1-(Ethylsulfonyl)azetidin-3-ylidene)acetonitrile1187595-85-2 P-Toluenesulfonylhydrazide1576-35-8 Carbimazole22232-54-8 4,6-Dimethyl-2-methylsulfonylpyrimidine35144-22-0 Ethyl 2-amino-4-thiazoleacetate53266-94-7 4-Amino-3-methylbenzene-1-sulfonamide53297-70-4 3-Amino-4-methylbenzenesulfonamide6274-28-8 Ethyl 2-amino-4-methylthiazole-5-carboxylate7210-76-6

Elsewhere

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