2-(Bromomethyl)-3-chloro-1,4-difluorobenzene

C7H4BrClF2CAS 90292-67-4241.46 g/mol

Open in Covalent MOL file
FFBrCl
Alkyl halideAryl halide

Properties

Molecular formula
C7H4BrClF2
Molar mass
241.46 g/mol
Exact mass
239.9153 Da
logP
3.51Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P321, P337+P317, P363, P405, P501

Identifiers

CAS number
90292-67-4
SMILES
Fc1ccc(F)c(CBr)c1Cl
InChIKey
KAADKOQBKOGBAA-UHFFFAOYSA-N
InChI
InChI=1S/C7H4BrClF2/c8-3-4-5(10)1-2-6(11)7(4)9/h1-2H,3H2

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Names and synonyms

2 names
  • Benzene, 2-(bromomethyl)-3-chloro-1,4-difluoro-
  • 2-Chloro-3,6-difluorobenzyl bromide

Work with 2-(Bromomethyl)-3-chloro-1,4-difluorobenzene

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

2,6-Difluorobenzyl bromide85118-00-962 % similar 2-Chloro-3,6-difluorobenzenemethanol261762-44-159 % similar 2-Chloro-3,6-difluorobenzenemethanamine261762-45-259 % similar 2,3,6-Trifluorobenzyl bromide151412-02-157 % similar 2-Chloro-6-fluorobenzyl bromide68220-26-857 % similar 2-(Bromomethyl)-1-fluoro-3-(trifluoromethyl)benzene239087-08-247 % similar 1-Chloro-2,6-difluorobenzene38361-37-446 % similar 3-Chloro-4-fluorobenzyl bromide192702-01-545 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-(Bromomethyl)-4-chloro-1,3-difluorobenzene261762-47-4

Elsewhere

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