4-Bromo-2,5-difluorobenzenesulfonamide

C₆H₄BrF₂NO₂SCAS 214209-98-0272.06 g/mol

Open in Covalent MOL file

Aryl halide Sulfonamide

Properties

Molecular formula: C₆H₄BrF₂NO₂S
Molar mass: 272.06 g/mol
Exact mass: 270.9114 Da
logP: 1.37Crippen estimate
Polar surface area: 60.2 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

214209-98-0

SMILES

NS(=O)(=O)c1cc(F)c(Br)cc1F

InChIKey

MINSVLXUGHJBPH-UHFFFAOYSA-N

InChI

InChI=1S/C6H4BrF2NO2S/c7-3-1-5(9)6(2-4(3)8)13(10,11)12/h1-2H,(H2,10,11,12)

Weigh it out

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

Names and synonyms

1 names

Benzenesulfonamide, 4-bromo-2,5-difluoro-

Work with 4-Bromo-2,5-difluorobenzenesulfonamide

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

4-Bromo-2,5-difluorobenzenesulfonyl chloride207974-14-959 % similar 1,4-Dibromo-2,5-difluorobenzene327-51-552 % similar 2,5-Difluorobenzenesulfonamide120022-63-151 % similar 1-Bromo-2,4,5-trifluorobenzene327-52-648 % similar 4-Bromo-2,5-difluoroaniline112279-60-445 % similar 2-Bromo-4-(trifluoromethyl)benzenesulfonamide351003-63-945 % similar 3,4-Difluorobenzenesulfonamide108966-71-842 % similar 1,2-Dibromo-4,5-difluorobenzene64695-78-941 % similar

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

Elsewhere

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