4-Chloro-2,5-difluorobenzoyl chloride

C₇H₂Cl₂F₂OCAS 132794-08-2210.99 g/mol

Open in Covalent MOL file

Acyl halide Aryl halide

Properties

Molecular formula: C₇H₂Cl₂F₂O
Molar mass: 210.99 g/mol
Exact mass: 209.9451 Da
logP: 3.00Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Identifiers

CAS number

132794-08-2

SMILES

O=C(Cl)c1cc(F)c(Cl)cc1F

InChIKey

DFLRZGOHFNFBQS-UHFFFAOYSA-N

InChI

InChI=1S/C7H2Cl2F2O/c8-4-2-5(10)3(7(9)12)1-6(4)11/h1-2H

Weigh it out

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

Names and synonyms

2 names

Benzoyl chloride, 4-chloro-2,5-difluoro-
2,5-Difluoro-4-chlorobenzoyl chloride

Work with 4-Chloro-2,5-difluorobenzoyl 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

2,4-Dichloro-5-fluorobenzoyl chloride86393-34-279 % similar 4-Chloro-2,5-difluorobenzoic acid132794-07-161 % similar 5-Chloro-2-fluorobenzoyl chloride394-29-656 % similar 4-Chloro-2-fluorobenzoyl chloride394-39-856 % similar 2,3,4,5-Tetrafluorobenzoyl chloride94695-48-455 % similar 2,4-Difluorobenzoyl chloride72482-64-553 % similar 2-Chloro-6-fluorobenzoyl chloride79455-63-353 % similar 5-Chloro-2,4-difluorobenzoic acid130025-33-151 % similar

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

Same formula

2-Chloro-3,6-difluorobenzoyl chloride261762-42-9 3-Chloro-2,6-difluorobenzoyl chloride261762-43-0

Elsewhere

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