chempirical

4-Bromo-2-fluorobenzyl chloride

C7H5BrClFCAS 85510-82-3223.47 g/mol

Open in Covalent MOL file
BrFCl
Alkyl halideAryl halide

Properties

Molecular formula
C7H5BrClF
Molar mass
223.47 g/mol
Exact mass
221.9247 Da
logP
3.33Crippen 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
85510-82-3
SMILES
C1=CC(=C(C=C1Br)F)CCl
InChIKey
UDKQGFMDBMYVHI-UHFFFAOYSA-N
InChI
InChI=1S/C7H5BrClF/c8-6-2-1-5(4-9)7(10)3-6/h1-3H,4H2

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Names and synonyms

1 names
  • 4-Bromo-1-(chloromethyl)-2-fluorobenzene

Work with 4-Bromo-2-fluorobenzyl 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

4-Bromo-2-fluorobenzyl bromide76283-09-563 % similar 4-Bromo-2-fluorobenzenemethanamine112734-22-261 % similar 4-Bromo-2-fluorobenzyl alcohol188582-62-961 % similar 2,4-Difluorobenzyl chloride452-07-360 % similar 4-Chloro-2-fluorobenzyl chloride87417-71-858 % similar 2-(4-Bromo-2-fluorophenyl)acetonitrile114897-91-556 % similar 4-Bromo-2-fluorobenzylamine hydrochloride147181-08-656 % similar 1-Bromo-3,4-difluorobenzene348-61-854 % similar

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

Same formula

3-Chloro-4-fluorobenzyl bromide192702-01-5 1-Bromo-2-chloro-5-fluoro-4-methylbenzene201849-17-4 1-Bromo-2-chloro-4-fluoro-5-methylbenzene201849-18-5 1-Bromo-2-chloro-4-fluoro-3-methylbenzene203302-92-5 4-(Bromomethyl)-1-chloro-2-fluorobenzene206362-80-3 2-Chloro-4-fluorobenzyl bromide45767-66-6 1-(Bromomethyl)-3-chloro-5-fluorobenzene493024-39-8 2-Chloro-6-fluorobenzyl bromide68220-26-8

Elsewhere

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