Pyridine-2-sulfonyl chloride

C₅H₄ClNO₂SCAS 66715-65-9177.60 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₄ClNO₂S
Molar mass: 177.60 g/mol
Exact mass: 176.9651 Da
logP: 1.01Crippen estimate
Polar surface area: 47.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers
H317 May cause an allergic skin reaction95% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P272, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P333+P317, P362+P364, P363, P405, P501

Identifiers

CAS number

66715-65-9

SMILES

C1=CC=NC(=C1)S(=O)(=O)Cl

InChIKey

JQJOGAGLBDBMLU-UHFFFAOYSA-N

InChI

InChI=1S/C5H4ClNO2S/c6-10(8,9)5-3-1-2-4-7-5/h1-4H

Weigh it out

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

Work with Pyridine-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

Pyridine-2-sulfonic acid15103-48-753 % similar Pyridine-2-sulfonyl fluoride878376-35-353 % similar 5-(2-Pyridyl)thiophene-2-sulfonyl chloride151858-64-949 % similar 2-Difluoromethanesulfonylpyridine1219454-89-348 % similar Fluoromethyl 2-pyridyl sulfone1365765-53-248 % similar 2-Pyridyl tribromomethyl sulfone59626-33-448 % similar 2-Chloropyridine-3-sulfonyl chloride6684-06-648 % similar 1,2-Benzenedisulfonyl dichloride6461-76-348 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Pyridine-3-sulfonyl chloride16133-25-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook