chempirical

2-Chloro-6-fluorobenzyl bromide

C7H5BrClFCAS 68220-26-8223.47 g/mol

Open in Covalent MOL file
ClBrF
Alkyl halideAryl halide

Properties

Molecular formula
C7H5BrClF
Molar mass
223.47 g/mol
Exact mass
221.9247 Da
logP
3.37Crippen 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
68220-26-8
SMILES
C1=CC(=C(C(=C1)Cl)CBr)F
InChIKey
IGUVNNXFTDCASP-UHFFFAOYSA-N
InChI
InChI=1S/C7H5BrClF/c8-4-5-6(9)2-1-3-7(5)10/h1-3H,4H2

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Work with 2-Chloro-6-fluorobenzyl 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

2,6-Difluorobenzyl bromide85118-00-972 % similar 2,6-Dichlorobenzyl bromide20443-98-568 % similar 2-Chloro-6-fluorobenzyl chloride55117-15-262 % similar 2-(Bromomethyl)-4-chloro-1,3-difluorobenzene261762-47-461 % similar 2-Chloro-6-fluorobenzenemethanamine15205-15-960 % similar 2-Chloro-6-fluorobenzylthiol170924-52-460 % similar 2-Chloro-6-fluorobenzenemethanol56456-50-960 % similar 2-(Bromomethyl)-3-chloro-1,4-difluorobenzene90292-67-457 % 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 4-Chloro-2-fluorobenzyl bromide71916-82-0

Elsewhere

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