chempirical

2,3-Dichlorothiophene-5-sulphonyl chloride

C4HCl3O2S2CAS 126714-85-0251.52 g/mol

Open in Covalent MOL file
SClClSOOCl
Aryl halide

Properties

Molecular formula
C4HCl3O2S2
Molar mass
251.52 g/mol
Exact mass
249.8484 Da
logP
2.98Crippen estimate
Polar surface area
34.1 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

Identifiers

CAS number
126714-85-0
SMILES
C1=C(SC(=C1Cl)Cl)S(=O)(=O)Cl
InChIKey
IVTWLTRKVRJPNG-UHFFFAOYSA-N
InChI
InChI=1S/C4HCl3O2S2/c5-2-1-3(10-4(2)6)11(7,8)9/h1H

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Names and synonyms

1 names
  • 4,5-Dichlorothiophene-2-sulfonyl chloride

Work with 2,3-Dichlorothiophene-5-sulphonyl 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

Similar compounds

5-Chloro-2-thiophenesulfonyl chloride2766-74-745 % similar 2,4,5-Trichlorobenzenesulfonyl chloride15945-07-044 % similar 2-Chlorobenzenesulfonyl chloride2905-23-942 % similar 5-Chloro-2,4-difluorobenzenesulfonyl chloride13656-57-042 % similar 3,4-Dichlorobenzenesulfonyl chloride98-31-741 % similar 5-Bromo-2-thiophenesulfonyl chloride55854-46-140 % similar 2,3-Dichlorobenzenesulfonyl chloride82417-45-640 % similar 2,4-Dichlorobenzenesulfonyl chloride16271-33-339 % similar

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

Elsewhere

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