4-Nitrobenzenemethanesulfonyl chloride

C₇H₆ClNO₄SCAS 4025-75-6235.64 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₆ClNO₄S
Molar mass: 235.64 g/mol
Exact mass: 234.9706 Da
Melting point: 92–93 °C
logP: 1.66Crippen estimate
Polar surface area: 77.3 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 3

Identifiers

CAS number

4025-75-6

SMILES

O=[N+]([O-])c1ccc(CS(=O)(=O)Cl)cc1

InChIKey

CAXRPEAFHWDFTD-UHFFFAOYSA-N

InChI

InChI=1S/C7H6ClNO4S/c8-14(12,13)5-6-1-3-7(4-2-6)9(10)11/h1-4H,5H2

Weigh it out

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

Names and synonyms

7 names

Benzenemethanesulfonyl chloride, 4-nitro-
α-Toluenesulfonyl chloride, p-nitro-
(p-Nitrophenyl)methanesulfonyl chloride
p-Nitrobenzylsulfonyl chloride
(4-Nitrophenyl)methanesulfonyl chloride
p-Nitro-α-toluenesulfonyl chloride
4-Nitrobenzylsulfonyl chloride

Work with 4-Nitrobenzenemethanesulfonyl chloride

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

4-Chloro-3-sulfamoylbenzoic acid1205-30-7 2-Methyl-5-nitrobenzenesulfonyl chloride121-02-8 4-Methyl-3-nitrobenzenesulfonyl chloride616-83-1 5-(Aminosulfonyl)-2-chlorobenzoic acid97-04-1 1-Chloro-4-(methylsulfonyl)-2-nitrobenzene97-07-4

Elsewhere

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