2,3-Difluorobenzyl bromide

C7H5BrF2CAS 113211-94-2207.02 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 48 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
113211-94-2
SMILES
C1=CC(=C(C(=C1)F)F)CBr
InChIKey
FTBSGSZZESQDBM-UHFFFAOYSA-N
InChI
InChI=1S/C7H5BrF2/c8-4-5-2-1-3-6(9)7(5)10/h1-3H,4H2

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Names and synonyms

1 names
  • 1-(Bromomethyl)-2,3-difluoro-benzene

Work with 2,3-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-(Bromomethyl)-2,3,4-trifluorobenzene157911-55-269 % similar 2-Fluorobenzyl bromide446-48-068 % similar 1-Bromo-3-(bromomethyl)-2-fluorobenzene149947-16-067 % similar 2-Bromo-1-(bromomethyl)-3-fluorobenzene1184918-22-664 % similar 3-Chloro-2-fluorobenzyl bromide85070-47-964 % similar 2-Fluoro-3-methylbenzyl bromide151412-12-362 % similar 2,3-Difluorobenzyl chloride446-57-161 % similar 2,3-Difluorobenzylamine72235-51-961 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3,5-Difluorobenzyl bromide141776-91-2 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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