5-Bromo-6-chloro-3-pyridinesulfonyl chloride

C5H2BrCl2NO2SCAS 216394-05-7290.94 g/mol

Open in Covalent MOL file
OSOClNClBr
Aryl halide

Properties

Molecular formula
C5H2BrCl2NO2S
Molar mass
290.94 g/mol
Exact mass
288.8367 Da
logP
2.42Crippen estimate
Polar surface area
47.0 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 8 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P321, P337+P317, P363, P405, P501

Identifiers

CAS number
216394-05-7
SMILES
O=S(=O)(Cl)c1cnc(Cl)c(Br)c1
InChIKey
TURGMVYIESHZBE-UHFFFAOYSA-N
InChI
InChI=1S/C5H2BrCl2NO2S/c6-4-1-3(12(8,10)11)2-9-5(4)7/h1-2H

Weigh it out

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Names and synonyms

3 names
  • 3-Pyridinesulfonyl chloride, 5-bromo-6-chloro-
  • 5-Bromo-6-chloropyridine-3-sulfonyl chloride
  • 3-Bromo-2-chloropyridine-5-sulfonyl chloride

Work with 5-Bromo-6-chloro-3-pyridinesulfonyl 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-6-chloro-3-pyridinamine130284-53-651 % similar 3-Bromo-2,5-dichloropyridine138006-41-450 % similar 2-Chloro-3,5-dibromopyridine40360-47-250 % similar 5-Bromopyridine-3-sulfonyl chloride65001-21-049 % similar 3-Bromo-2-chloro-5-methylpyridine17282-03-047 % similar 3-Bromo-2-chloro-5-fluoropyridine884494-36-447 % similar 2-Chloro-5-pyridinesulfonyl chloride6684-39-546 % similar 5-Bromo-6-chloropyridine-3-carboxylic acid29241-62-144 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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