chempirical

2-Bromo-1,3-difluorobenzene

C6H3BrF2CAS 64248-56-2192.99 g/mol

Open in Covalent MOL file
FFBr
Aryl halide

Properties

Molecular formula
C6H3BrF2
Molar mass
192.99 g/mol
Exact mass
191.9386 Da
Boiling point
135–137 °C
logP
2.73Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
64248-56-2
SMILES
Fc1cccc(F)c1Br
InChIKey
HRZTZLCMURHWFY-UHFFFAOYSA-N
InChI
InChI=1S/C6H3BrF2/c7-6-4(8)2-1-3-5(6)9/h1-3H

Weigh it out

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

Names and synonyms

5 names
  • (2,6-Difluorophenyl) bromide
  • 2,6-Difluoro-1-bromobenzene
  • Benzene, 2-bromo-1,3-difluoro-
  • 2,6-Difluorobromobenzene
  • 1-Bromo-2,6-difluorobenzene

Work with 2-Bromo-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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Bromo-3-fluoroaniline111721-75-665 % similar 2-Bromo-3-fluorophenol443-81-265 % similar 2-Bromo-1-fluoro-3-methylbenzene59907-13-065 % similar 2-Bromo-3-fluorobenzotrifluoride104540-42-360 % similar 2-Bromo-1-(bromomethyl)-3-fluorobenzene1184918-22-660 % similar 1-Bromo-2-fluorobenzene1072-85-152 % similar 2-Bromo-3-fluorobenzoic acid132715-69-652 % similar 1,4-Dibromo-3,5-difluorobenzene128259-71-250 % similar

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

Same formula

1-Bromo-2,4-difluorobenzene348-57-2 1-Bromo-3,4-difluorobenzene348-61-8 1-Bromo-2,3-difluorobenzene38573-88-5 1-Bromo-2,5-difluorobenzene399-94-0 1-Bromo-3,5-difluorobenzene461-96-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook