2,3,4-Trichlorobenzenesulfonyl chloride

C₆H₂Cl₄O₂SCAS 34732-09-7279.94 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₂Cl₄O₂S
Molar mass: 279.94 g/mol
Exact mass: 277.8530 Da
Melting point: 65–66 °C
logP: 3.57Crippen estimate
Polar surface area: 34.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number

34732-09-7

SMILES

O=S(=O)(Cl)c1ccc(Cl)c(Cl)c1Cl

InChIKey

JDAJYNHGBUXIKS-UHFFFAOYSA-N

InChI

InChI=1S/C6H2Cl4O2S/c7-3-1-2-4(13(10,11)12)6(9)5(3)8/h1-2H

Weigh it out

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Names and synonyms

3 names

Benzenesulfonyl chloride, 2,3,4-trichloro-
2,3,4-Trichlorophenylsulfonyl chloride
2,3,4-Trichlorobenzene-1-sulfonyl chloride

Work with 2,3,4-Trichlorobenzenesulfonyl 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

2,3-Dichlorobenzenesulfonyl chloride82417-45-671 % similar 2-Chlorobenzenesulfonyl chloride2905-23-953 % similar 2,4-Dichlorobenzenesulfonyl chloride16271-33-353 % similar 2,5-Dichlorobenzenesulfonyl chloride5402-73-353 % similar 4-Bromo-2-chlorobenzenesulfonyl chloride351003-52-650 % similar 1,2,3,4-Tetrachlorobenzene634-66-250 % similar 2-Chloro-4-fluorobenzenesulfonyl chloride85958-57-250 % similar 3-Chloro-2-fluorobenzenesulfonyl chloride351003-48-047 % similar

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

Same formula

2,4,5-Trichlorobenzenesulfonyl chloride15945-07-0 2,4,6-Trichlorobenzenesulfonyl chloride51527-73-2

Elsewhere

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