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

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

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

Weigh it out

Type any one amount. The others follow from the molar mass.

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-difluorobenzene10105-60-957 % similar 1,2-Dibromo-3,5-difluorobenzene139215-43-357 % similar 2-Bromo-1-chloro-3-fluorobenzene309721-44-657 % similar 2-Bromo-3,5-difluorophenol325486-43-953 % similar 2-Chloro-4,6-difluoroaniline36556-56-653 % similar 1-Chloro-2,4-difluorobenzene1435-44-548 % similar 1-Chloro-2,5-difluorobenzene2367-91-148 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Bromo-2-chloro-1,3-difluorobenzene176673-72-6 1-Bromo-3-chloro-2,4-difluorobenzene201849-13-0

Elsewhere

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