chempirical

2,5-Difluorobenzyl chloride

C7H5ClF2CAS 495-07-8162.56 g/mol

Open in Covalent MOL file
FClF
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
495-07-8
SMILES
C1=CC(=C(C=C1F)CCl)F
InChIKey
INXKTZMJFPRVAY-UHFFFAOYSA-N
InChI
InChI=1S/C7H5ClF2/c8-4-5-3-6(9)1-2-7(5)10/h1-3H,4H2

Weigh it out

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

Work with 2,5-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

2,5-Difluorobenzenemethanol75853-20-259 % similar 2,5-Difluorobenzyl bromide85117-99-359 % similar 2,5-Difluorobenzenemethanamine85118-06-559 % similar 1-(Chloromethyl)-2,4,5-trifluorobenzene243139-71-156 % similar 2-Fluorobenzyl chloride345-35-754 % similar 2,5-Difluorobenzeneacetonitrile69584-87-853 % similar 1,2,4-Trifluorobenzene367-23-750 % similar 2,5-Difluorobenzeneacetic acid85068-27-549 % 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 2,6-Difluorobenzyl chloride697-73-4 3,4-Difluorobenzyl chloride698-80-6

Elsewhere

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