chempirical

1-Bromo-2-chloro-4,6-diflorobenzene

C6H2BrClF2CAS 1020198-58-6227.43 g/mol

Open in Covalent MOL file
FBrClF
Aryl halide

Properties

Molecular formula
C6H2BrClF2
Molar mass
227.43 g/mol
Exact mass
225.8996 Da
logP
3.38Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
1020198-58-6
SMILES
C1=C(C=C(C(=C1F)Br)Cl)F
InChIKey
QOFBXVZPBPTCJH-UHFFFAOYSA-N
InChI
InChI=1S/C6H2BrClF2/c7-6-4(8)1-3(9)2-5(6)10/h1-2H

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Names and synonyms

1 names
  • 2-Bromo-1-chloro-3,5-difluorobenzene

Work with 1-Bromo-2-chloro-4,6-diflorobenzene

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-Bromo-1,3,5-trifluorobenzene2367-76-267 % similar 1,2-Dibromo-3,5-difluorobenzene139215-43-357 % similar 1-Chloro-2,4-difluorobenzene1435-44-548 % similar 1,3-Dichloro-2,5-difluorobenzene2367-80-848 % similar 2-Bromo-6-chloro-4-fluorobenzenamine201849-14-145 % similar 1-Bromo-2-chloro-4-fluorobenzene110407-59-545 % similar 2,6-Dichloro-4-fluorobenzenamine344-19-445 % similar 2,6-Dichloro-4-fluorophenol392-71-245 % similar

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

Elsewhere

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