4,5-Dibromothiophene-2-sulfonyl chloride

C₄HBr₂ClO₂S₂CAS 81606-31-7340.43 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄HBr₂ClO₂S₂
Molar mass: 340.43 g/mol
Exact mass: 337.7473 Da
logP: 3.20Crippen estimate
Polar surface area: 34.1 Å²
H-bond donors / acceptors: 0 / 3
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

81606-31-7

SMILES

C1=C(SC(=C1Br)Br)S(=O)(=O)Cl

InChIKey

WJYGHWXWQSCONR-UHFFFAOYSA-N

InChI

InChI=1S/C4HBr2ClO2S2/c5-2-1-3(10-4(2)6)11(7,8)9/h1H

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Names and synonyms

1 names

4,5-Dibromothiophene-2-sulphonyl chloride

Work with 4,5-Dibromothiophene-2-sulfonyl 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-Bromo-2-thiophenesulfonyl chloride55854-46-147 % similar 2,3-Dichlorothiophene-5-sulphonyl chloride126714-85-046 % similar 1-Benzothiophene-2-sulfonyl chloride90001-64-243 % similar 2,3,5-Tribromothiophene3141-24-042 % similar 2-Bromobenzenesulphonyl chloride2905-25-141 % similar 2,5-Dibromobenzenesulfonyl chloride23886-64-841 % similar 2,4-Dibromobenzenesulfonyl chloride72256-95-241 % similar 5-Chloro-2-thiophenesulfonyl chloride2766-74-740 % similar

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

Elsewhere

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