chempirical

3,5-Difluorobenzyl bromide

C7H5BrF2CAS 141776-91-2207.02 g/mol

Open in Covalent MOL file
FFBr
Alkyl halideAryl halide

Properties

Molecular formula
C7H5BrF2
Molar mass
207.02 g/mol
Exact mass
205.9543 Da
logP
2.86Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Identifiers

CAS number
141776-91-2
SMILES
C1=C(C=C(C=C1F)F)CBr
InChIKey
KVSVNRFSKRFPIL-UHFFFAOYSA-N
InChI
InChI=1S/C7H5BrF2/c8-4-5-1-6(9)3-7(10)2-5/h1-3H,4H2

Weigh it out

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

Work with 3,5-Difluorobenzyl bromide

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

1-Bromo-3-(bromomethyl)-5-fluorobenzene216755-57-671 % similar 1-(Bromomethyl)-3-chloro-5-fluorobenzene493024-39-868 % similar 3-Fluorobenzyl bromide456-41-763 % similar 4-Fluorobenzyl bromide459-46-157 % similar 3,4,5-Trifluorobenzyl bromide220141-72-052 % similar 1-Ethyl-3,5-difluorobenzene117358-52-850 % similar 1,3,5-Trifluorobenzene372-38-350 % similar 3,5-Difluorobenzylamine90390-27-550 % similar

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

Same formula

2,3-Difluorobenzyl bromide113211-94-2 1-Bromo-2,4-difluoro-5-methylbenzene159277-47-1 2,4-Difluorobenzyl bromide23915-07-3 2,5-Difluorobenzyl bromide85117-99-3 2,6-Difluorobenzyl bromide85118-00-9 3,4-Difluorobenzyl bromide85118-01-0 1-Bromo-4,5-difluoro-2-methylbenzene875664-38-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook