chempirical

1,2-Benzenedisulfonyl dichloride

C6H4Cl2O4S2CAS 6461-76-3275.11 g/mol

Open in Covalent MOL file
SOOClSOOCl

Properties

Molecular formula
C6H4Cl2O4S2
Molar mass
275.11 g/mol
Exact mass
273.8928 Da
logP
1.54Crippen estimate
Polar surface area
68.3 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
2

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
6461-76-3
SMILES
C1=CC=C(C(=C1)S(=O)(=O)Cl)S(=O)(=O)Cl
InChIKey
YBGQXNZTVFEKEN-UHFFFAOYSA-N
InChI
InChI=1S/C6H4Cl2O4S2/c7-13(9,10)5-3-1-2-4-6(5)14(8,11)12/h1-4H

Weigh it out

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Work with 1,2-Benzenedisulfonyl dichloride

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-Methanesulfonylbenzene-1-sulfonyl chloride89265-35-071 % similar 2-Chlorobenzenesulfonyl chloride2905-23-970 % similar 2-Bromobenzenesulphonyl chloride2905-25-170 % similar 1,5-Naphthalenedisulfonyl chloride1928-01-468 % similar 2-Methylbenzenesulfonyl chloride133-59-567 % similar 2-Fluorobenzenesulfonyl chloride2905-21-767 % similar 2-Iodobenzene-1-sulfonyl chloride63059-29-067 % similar 1-Naphthalenesulfonyl chloride85-46-164 % similar

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

Same formula

1,3-Benzenedisulfonyl dichloride585-47-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook