chempirical

2-Bromo-1-fluoro-4-nitrobenzene

C6H3BrFNO2CAS 701-45-1220.00 g/mol

Open in Covalent MOL file
ON+O−FBr
Aryl halideNitro

Properties

Molecular formula
C6H3BrFNO2
Molar mass
220.00 g/mol
Exact mass
218.9331 Da
Melting point
60–62 °C
logP
2.50Crippen estimate
Polar surface area
43.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
701-45-1
SMILES
O=[N+]([O-])c1ccc(F)c(Br)c1
InChIKey
FAWMTDSAMOCUAR-UHFFFAOYSA-N
InChI
InChI=1S/C6H3BrFNO2/c7-5-3-4(9(10)11)1-2-6(5)8/h1-3H

Weigh it out

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

Names and synonyms

4 names
  • Benzene, 2-bromo-1-fluoro-4-nitro-
  • 3-Bromo-4-fluoronitrobenzene
  • 3-Bromo-4-fluoro-1-nitrobenzene
  • 1-Bromo-2-fluoro-5-nitrobenzene

Work with 2-Bromo-1-fluoro-4-nitrobenzene

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

Same formula

4-Bromo-2-fluoro-1-nitrobenzene321-23-3 6-Bromo-5-fluoro-3-pyridinecarboxylic acid38186-87-7 2-Bromo-5-fluoro-3-pyridinecarboxylic acid38186-89-9 1-Bromo-4-fluoro-2-nitrobenzene446-09-3 5-Bromo-3-fluoropicolinic acid669066-91-5 2-Bromo-4-fluoro-1-nitrobenzene700-36-7 1-Bromo-3-fluoro-5-nitrobenzene7087-65-2 1-Bromo-3-fluoro-2-nitrobenzene886762-70-5

Elsewhere

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