chempirical

2-Fluoro-6-nitrobenzenamine

C6H5FN2O2CAS 17809-36-8156.12 g/mol

Open in Covalent MOL file
NH2FN+OO−
Aryl halideNitroPrimary amine

Properties

Molecular formula
C6H5FN2O2
Molar mass
156.12 g/mol
Exact mass
156.0335 Da
Melting point
130 °C
logP
1.32Crippen estimate
Polar surface area
69.2 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
17809-36-8
SMILES
Nc1c(F)cccc1[N+](=O)[O-]
InChIKey
BHWHYGWMNMCXBA-UHFFFAOYSA-N
InChI
InChI=1S/C6H5FN2O2/c7-4-2-1-3-5(6(4)8)9(10)11/h1-3H,8H2

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Names and synonyms

5 names
  • Benzenamine, 2-fluoro-6-nitro-
  • Aniline, 2-fluoro-6-nitro-
  • 2-Fluoro-6-nitroaniline
  • 6-Fluoro-2-nitroaniline
  • 2-Fluoro-6-nitro-phenylamine

Work with 2-Fluoro-6-nitrobenzenamine

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

2,6-Dinitroaniline606-22-472 % similar 1,2-Difluoro-3-nitrobenzene6921-22-866 % similar 1-Fluoro-2-nitrobenzene1493-27-265 % similar 3-Nitro-1,2-phenylenediamine3694-52-864 % similar 2-Chloro-1-fluoro-3-nitrobenzene21397-07-962 % similar 2-Bromo-6-nitrobenzenamine59255-95-762 % similar 2-Chloro-6-nitrobenzenamine769-11-962 % similar 2-Fluoro-6-nitrophenol1526-17-660 % similar

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

Same formula

2-Fluoro-6-methyl-3-nitropyridine19346-45-3 2-Fluoro-3-methyl-5-nitropyridine19346-46-4 5-Fluoro-2-nitrobenzenamine2369-11-1 3-Fluoro-5-nitrobenzenamine2369-12-2 3-Fluoro-4-nitrobenzenamine2369-13-3 4-Fluoro-3-nitroaniline364-76-1 4-Fluoro-2-nitroaniline364-78-3 2-Fluoro-4-nitrobenzenamine369-35-7

Elsewhere

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