2,6-Difluorobenzyl chloride

C7H5ClF2CAS 697-73-4162.56 g/mol

Open in Covalent MOL file
FFCl
Alkyl halideAryl halide

Properties

Molecular formula
C7H5ClF2
Molar mass
162.56 g/mol
Exact mass
162.0048 Da
logP
2.70Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)

Aggregated from 51 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
697-73-4
SMILES
Fc1cccc(F)c1CCl
InChIKey
MJXRENZUAQXZGJ-UHFFFAOYSA-N
InChI
InChI=1S/C7H5ClF2/c8-4-5-6(9)2-1-3-7(5)10/h1-3H,4H2

Weigh it out

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

Names and synonyms

3 names
  • Benzene, 2-(chloromethyl)-1,3-difluoro-
  • Toluene, α-chloro-2,6-difluoro-
  • 2-(Chloromethyl)-1,3-difluorobenzene

Work with 2,6-Difluorobenzyl 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-Chloro-6-fluorobenzyl chloride55117-15-275 % similar 2-Fluorobenzyl chloride345-35-756 % similar 2,6-Difluorobenzenemethanol19064-18-752 % similar 2,6-Difluorobenzylamine69385-30-452 % similar 2,6-Difluorobenzyl bromide85118-00-952 % similar 2,6-Dichlorobenzyl chloride2014-83-750 % similar 2-Chloro-6-fluorobenzenemethanamine15205-15-948 % similar 2-Chloro-6-fluorobenzylthiol170924-52-448 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3,5-Difluorobenzyl chloride220141-71-9 2,3-Difluorobenzyl chloride446-57-1 2,4-Difluorobenzyl chloride452-07-3 2,5-Difluorobenzyl chloride495-07-8 3,4-Difluorobenzyl chloride698-80-6

Elsewhere

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