chempirical

2,3-Difluorobenzyl chloride

C7H5ClF2CAS 446-57-1162.56 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

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
446-57-1
SMILES
C1=CC(=C(C(=C1)F)F)CCl
InChIKey
OVUKQQRPTLPXTD-UHFFFAOYSA-N
InChI
InChI=1S/C7H5ClF2/c8-4-5-2-1-3-6(9)7(5)10/h1-3H,4H2

Weigh it out

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Names and synonyms

1 names
  • 1-(Chloromethyl)-2,3-difluorobenzene

Work with 2,3-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-Fluorobenzyl chloride345-35-765 % similar 2,3-Difluorobenzyl bromide113211-94-261 % similar 2,3-Difluorobenzylamine72235-51-959 % similar 2,3-Difluorobenzyl alcohol75853-18-859 % similar 1,2,3-Trifluorobenzene1489-53-854 % similar 2,3-Difluorobenzeneacetonitrile145689-34-553 % similar 2,3-Difluorobenzeneacetic acid145689-41-449 % similar 2-Chloro-6-fluorobenzyl chloride55117-15-248 % similar

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

Same formula

3,5-Difluorobenzyl chloride220141-71-9 2,4-Difluorobenzyl chloride452-07-3 2,5-Difluorobenzyl chloride495-07-8 2,6-Difluorobenzyl chloride697-73-4 3,4-Difluorobenzyl chloride698-80-6

Elsewhere

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