chempirical

2,4-Dimethylbenzenesulfonyl chloride

C8H9ClO2SCAS 609-60-9204.67 g/mol

Open in Covalent MOL file
SOOCl
HalogenSulfone

Properties

Molecular formula
C8H9ClO2S
Molar mass
204.67 g/mol
Exact mass
204.0012 Da
Melting point
29–31 °C
Boiling point
152–154 °C (at 12 Torr)
logP
2.23Crippen estimate
Polar surface area
34.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
609-60-9
SMILES
Cc1ccc(S(=O)(=O)Cl)c(C)c1
InChIKey
FREOGXBZEAMJQN-UHFFFAOYSA-N
InChI
InChI=1S/C8H9ClO2S/c1-6-3-4-8(7(2)5-6)12(9,10)11/h3-5H,1-2H3

Weigh it out

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

Names and synonyms

6 names
  • Benzenesulfonyl chloride, 2,4-dimethyl-
  • 2,4-Xylenesulfonyl chloride
  • 2,4-Dimethylphenylsulfonyl chloride
  • 3,5-Dimethylbenzene-2-sulfonyl chloride
  • 2,4-Dimethylbenzene-1-sulfonylchloride
  • 2,4-Dimethylbenzene-1-sulfonyl chloride

Work with 2,4-Dimethylbenzenesulfonyl 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

2,5-Dimethylbenzenesulfonyl chloride19040-62-1 3,5-Dimethylbenzenesulfonyl chloride2905-27-3 3,4-Dimethylbenzenesulfonyl chloride2905-30-8 [(2-Chloroethyl)sulfonyl]benzene938-09-0

Elsewhere

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