chempirical

2,6-Dibromo-4-fluoroaniline

C6H4Br2FNCAS 344-18-3268.91 g/mol

Open in Covalent MOL file
H2NBrFBr
Aryl halidePrimary amine

Properties

Molecular formula
C6H4Br2FN
Molar mass
268.91 g/mol
Exact mass
266.8695 Da
Melting point
63–64 °C
logP
2.93Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
344-18-3
SMILES
Nc1c(Br)cc(F)cc1Br
InChIKey
VHPLZFGCNLDYQH-UHFFFAOYSA-N
InChI
InChI=1S/C6H4Br2FN/c7-4-1-3(9)2-5(8)6(4)10/h1-2H,10H2

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Names and synonyms

5 names
  • Benzenamine, 2,6-dibromo-4-fluoro-
  • Aniline, 2,6-dibromo-4-fluoro-
  • 2,6-Dibromo-4-fluorobenzenamine
  • NSC 51868
  • 2,6-Dibromo-4-fluoro-phenylamine

Work with 2,6-Dibromo-4-fluoroaniline

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-4,6-difluorobenzenamine444-14-475 % similar 2-Bromo-6-chloro-4-fluorobenzenamine201849-14-169 % similar 2-Bromo-4-fluoro-6-methylbenzenamine202865-77-869 % similar 2-Bromo-4,6-difluoroaniline hydrobromide101471-20-967 % similar 2-Bromo-4-fluoro-6-(trifluoromethyl)benzenamine875664-27-064 % similar 2-Bromo-4-fluoro-6-nitroaniline10472-88-558 % similar 1,3-Dibromo-2,5-difluorobenzene128259-68-757 % similar 2,4,6-Tribromoaniline147-82-057 % similar

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

Same formula

2,4-Dibromo-6-fluoroaniline141474-37-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook