chempirical

1-Bromo-3,4-difluorobenzene

C6H3BrF2CAS 348-61-8192.99 g/mol

Open in Covalent MOL file
FBrF
Aryl halide

Properties

Molecular formula
C6H3BrF2
Molar mass
192.99 g/mol
Exact mass
191.9386 Da
Boiling point
151.5–152.5 °C
logP
2.73Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
348-61-8
SMILES
Fc1ccc(Br)cc1F
InChIKey
YMQPKONILWWJQG-UHFFFAOYSA-N
InChI
InChI=1S/C6H3BrF2/c7-4-1-2-5(8)6(9)3-4/h1-3H

Weigh it out

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

Names and synonyms

5 names
  • Benzene, 4-bromo-1,2-difluoro-
  • 4-Bromo-1,2-difluorobenzene
  • 3,4-Difluorobromobenzene
  • NSC 10251
  • 3,4-Difluoro-1-bromobenzene

Work with 1-Bromo-3,4-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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,4-Dibromo-1-fluorobenzene1435-53-665 % similar 4-Bromo-2-fluoro-1-iodobenzene105931-73-560 % similar 5-Bromo-2-fluorophenol112204-58-760 % similar 3-Iodo-4-fluorobromobenzene116272-41-460 % similar 4-Bromo-2-fluorophenol2105-94-460 % similar 5-Bromo-2-fluorobenzenamine2924-09-660 % similar 4-Bromo-2-fluoroaniline367-24-860 % similar 4-Bromo-2-fluorotoluene51436-99-860 % similar

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

Same formula

1-Bromo-2,4-difluorobenzene348-57-2 1-Bromo-2,3-difluorobenzene38573-88-5 1-Bromo-2,5-difluorobenzene399-94-0 1-Bromo-3,5-difluorobenzene461-96-1 2-Bromo-1,3-difluorobenzene64248-56-2

Elsewhere

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