chempirical

2,6-Dichlorobenzenesulfonylchloride

C6H3Cl3O2SCAS 6579-54-0245.50 g/mol

Open in Covalent MOL file
ClSOOClCl
Aryl halide

Properties

Molecular formula
C6H3Cl3O2S
Molar mass
245.50 g/mol
Exact mass
243.8919 Da
logP
2.92Crippen estimate
Polar surface area
34.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
6579-54-0
SMILES
C1=CC(=C(C(=C1)Cl)S(=O)(=O)Cl)Cl
InChIKey
WGGKQIKICKLWGN-UHFFFAOYSA-N
InChI
InChI=1S/C6H3Cl3O2S/c7-4-2-1-3-5(8)6(4)12(9,10)11/h1-3H

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Names and synonyms

1 names
  • 2,6-Dichlorobenzenesulfonyl chloride

Work with 2,6-Dichlorobenzenesulfonylchloride

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

2,4,6-Trichlorobenzenesulfonyl chloride51527-73-268 % similar 4-Bromo-2,6-dichlorobenzene-1-sulfonyl chloride351003-54-863 % similar 2-Chlorobenzenesulfonyl chloride2905-23-962 % similar 2,6-Dichloro-4-(trifluoromethyl)benzenesulfonyl chloride175205-76-257 % similar 1,3-Benzenedisulfonyl dichloride585-47-756 % similar 2,6-Difluorobenzenesulfonyl chloride60230-36-656 % similar 3-Chloro-2-fluorobenzenesulfonyl chloride351003-48-053 % similar 3-Chloro-2-methylbenzenesulfonyl chloride80563-86-653 % similar

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

Same formula

2,4-Dichlorobenzenesulfonyl chloride16271-33-3 2,5-Dichlorobenzenesulfonyl chloride5402-73-3 3,5-Dichlorobenzenesulfonyl chloride705-21-5 2,3-Dichlorobenzenesulfonyl chloride82417-45-6 3,4-Dichlorobenzenesulfonyl chloride98-31-7

Elsewhere

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