1-Bromo-3-fluoro-5-nitrobenzene

C₆H₃BrFNO₂CAS 7087-65-2220.00 g/mol

Open in Covalent MOL file

Aryl halide Nitro

Properties

Molecular formula: C₆H₃BrFNO₂
Molar mass: 220.00 g/mol
Exact mass: 218.9331 Da
logP: 2.50Crippen estimate
Polar surface area: 43.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Identifiers

CAS number

7087-65-2

SMILES

O=[N+]([O-])c1cc(F)cc(Br)c1

InChIKey

SWXVEPMSQBEVRH-UHFFFAOYSA-N

InChI

InChI=1S/C6H3BrFNO2/c7-4-1-5(8)3-6(2-4)9(10)11/h1-3H

Weigh it out

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

Names and synonyms

1 names

Benzene, 1-bromo-3-fluoro-5-nitro-

Work with 1-Bromo-3-fluoro-5-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 2-Bromo-1-fluoro-4-nitrobenzene701-45-1 1-Bromo-3-fluoro-2-nitrobenzene886762-70-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook