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

C₆H₂BrClF₂CAS 176673-72-6227.43 g/mol

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Properties

Molecular formula: C₆H₂BrClF₂
Molar mass: 227.43 g/mol
Exact mass: 225.8996 Da
logP: 3.38Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

176673-72-6

SMILES

C1=C(C=C(C(=C1F)Cl)F)Br

InChIKey

SWELJVAWQMCJLG-UHFFFAOYSA-N

InChI

InChI=1S/C6H2BrClF2/c7-3-1-4(9)6(8)5(10)2-3/h1-2H

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Names and synonyms

1 names

4-Chloro-3,5-difluorobromobenzene

Work with 5-Bromo-2-chloro-1,3-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

1,5-Dibromo-2-chloro-3-fluorobenzene202925-04-075 % similar 1,4-Dibromo-3,5-difluorobenzene128259-71-257 % similar 5-Bromo-1,2,3-trifluorobenzene138526-69-957 % similar 1-Chloro-2,4,6-trifluorobenzene2106-40-357 % similar 4-Chloro-3,5-difluorophenol2268-03-354 % similar 4-Bromo-2,6-difluorophenol104197-13-952 % similar 5-Bromo-1,3-difluoro-2-iodobenzene160976-02-352 % similar 5-Bromo-1,3-difluoro-2-methylbenzene179617-08-452 % similar

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

Same formula

1-Bromo-2-chloro-4,6-diflorobenzene1020198-58-6 1-Bromo-3-chloro-2,4-difluorobenzene201849-13-0

Elsewhere

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