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

Hazards

Danger
Corrosive (GHS05)

Aggregated from 50 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
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-Fluoro-5-(trifluoromethyl)benzyl bromide239087-09-363 % similar 3-Fluorobenzyl bromide456-41-763 % similar 1,3,5-Tris(bromomethyl)benzene18226-42-158 % similar 4-Fluorobenzyl bromide459-46-157 % similar 2,4,6-Trifluorobenzyl bromide151411-98-252 % similar 3,4,5-Trifluorobenzyl bromide220141-72-052 % 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 5-Bromo-1,3-difluoro-2-methylbenzene179617-08-4 1-Bromo-2,4-difluoro-3-methylbenzene221220-97-9 2,4-Difluorobenzyl bromide23915-07-3 1-Bromo-4-difluoromethylbenzene51776-71-7 2,5-Difluorobenzyl bromide85117-99-3 2,6-Difluorobenzyl bromide85118-00-9

Elsewhere

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