chempirical

2-Fluoro-4-nitrobenzenamine

C6H5FN2O2CAS 369-35-7156.12 g/mol

Open in Covalent MOL file
H2NN+OO−F
Aryl halideNitroPrimary amine

Properties

Molecular formula
C6H5FN2O2
Molar mass
156.12 g/mol
Exact mass
156.0335 Da
Melting point
135–136 °C
logP
1.32Crippen estimate
Polar surface area
69.2 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
369-35-7
SMILES
Nc1ccc([N+](=O)[O-])cc1F
InChIKey
LETNCFZQCNCACQ-UHFFFAOYSA-N
InChI
InChI=1S/C6H5FN2O2/c7-5-3-4(9(10)11)1-2-6(5)8/h1-3H,8H2

Weigh it out

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

Names and synonyms

6 names
  • Benzenamine, 2-fluoro-4-nitro-
  • Aniline, 2-fluoro-4-nitro-
  • 2-Fluoro-4-nitroaniline
  • NSC 402982
  • (2-Fluoro-4-nitrophenyl)amine
  • 4-Nitro-2-fluoroaniline

Work with 2-Fluoro-4-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-Fluoro-5-nitrobenzenamine369-36-875 % similar 3,4-Difluoronitrobenzene369-34-668 % similar 4-Nitro-1,2-phenylenediamine99-56-968 % similar 2,4-Dinitroaniline97-02-964 % similar 2-Amino-5-nitrophenol121-88-062 % similar 2-Chloro-4-nitroaniline121-87-960 % similar 2-Bromo-4-nitrobenzenamine13296-94-160 % similar 2-Fluoro-1-methyl-4-nitrobenzene1427-07-260 % similar

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

Same formula

2-Fluoro-6-nitrobenzenamine17809-36-8 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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook