2,5-Difluorobenzenesulfonyl chloride

C₆H₃ClF₂O₂SCAS 26120-86-5212.59 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₃ClF₂O₂S
Molar mass: 212.59 g/mol
Exact mass: 211.9510 Da
logP: 1.89Crippen 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
H318 Causes serious eye damage84.8% of notifiers

Aggregated from 46 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+P354+P338, P316, P317, P321, P363, P405, P501

Identifiers

CAS number

26120-86-5

SMILES

O=S(=O)(Cl)c1cc(F)ccc1F

InChIKey

CELLJWUVMKEJDY-UHFFFAOYSA-N

InChI

InChI=1S/C6H3ClF2O2S/c7-12(10,11)6-3-4(8)1-2-5(6)9/h1-3H

Weigh it out

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

Names and synonyms

2 names

Benzenesulfonyl chloride, 2,5-difluoro-
2,5-Difluorobenzene-1-sulfonyl chloride

Work with 2,5-Difluorobenzenesulfonyl 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-Chloro-2-fluorobenzenesulfonyl chloride351003-49-166 % similar 5-Fluoro-2-methylbenzenesulfonyl chloride445-05-664 % similar 2-Fluoro-5-methylbenzenesulfonyl chloride870704-14-664 % similar 2-Chloro-4-fluorobenzenesulfonyl chloride85958-57-261 % similar 2,4,5-Trifluorobenzenesulfonyl chloride220227-21-460 % similar 2-Bromo-4-fluorobenzene-1-sulfonyl chloride351003-45-759 % similar 4-Fluoro-2-methylbenzenesulfonyl chloride7079-48-359 % similar 2-Fluorobenzenesulfonyl chloride2905-21-758 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,4-Difluorobenzenesulfonyl chloride13918-92-8 3,4-Difluorobenzenesulfonyl chloride145758-05-0 3,5-Difluorobenzenesulfonyl chloride210532-25-5 2,6-Difluorobenzenesulfonyl chloride60230-36-6

Elsewhere

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