N-Methyl-4-nitrobenzenemethanesulfonamide

C₈H₁₀N₂O₄SCAS 85952-29-0230.24 g/mol

Open in Covalent MOL file

Nitro Secondary Amine Sulfone Tertiary Amine

Properties

Molecular formula: C₈H₁₀N₂O₄S
Molar mass: 230.24 g/mol
Exact mass: 230.0361 Da
logP: 0.64Crippen estimate
Polar surface area: 89.3 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 4

Identifiers

CAS number

85952-29-0

SMILES

CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1

InChIKey

KZWPBAASZYQWIV-UHFFFAOYSA-N

InChI

InChI=1S/C8H10N2O4S/c1-9-15(13,14)6-7-2-4-8(5-3-7)10(11)12/h2-5,9H,6H2,1H3

Weigh it out

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

Names and synonyms

4 names

Benzenemethanesulfonamide, N-methyl-4-nitro-
4-(((Methylamino)sulfonyl)methyl)nitrobenzene
1-(4-Nitrophenyl)-N-methylmethanesulfonamide
(4-Nitro-phenyl)-methanesulfonic acid methylamide

Work with N-Methyl-4-nitrobenzenemethanesulfonamide

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

Same formula

(6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid15690-38-7 Asulam3337-71-1 4-Acetamido-2-aminobenzenesulfonic acid88-64-2 5-Acetamido-2-aminobenzenesulfonic acid96-78-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook