chempirical

4-Methoxy-3-nitrobenzenamine

C7H8N2O3CAS 577-72-0168.15 g/mol

Open in Covalent MOL file
ONH2N+OO−
EtherNitroPrimary amine

Properties

Molecular formula
C7H8N2O3
Molar mass
168.15 g/mol
Exact mass
168.0535 Da
Melting point
46–47 °C
logP
1.19Crippen estimate
Polar surface area
78.4 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
2

Identifiers

CAS number
577-72-0
SMILES
COc1ccc(N)cc1[N+](=O)[O-]
InChIKey
RUFOHZDEBFYQSV-UHFFFAOYSA-N
InChI
InChI=1S/C7H8N2O3/c1-12-7-3-2-5(8)4-6(7)9(10)11/h2-4H,8H2,1H3

Weigh it out

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

Names and synonyms

7 names
  • Benzenamine, 4-methoxy-3-nitro-
  • p-Anisidine, 3-nitro-
  • 1-Amino-3-nitro-4-methoxybenzene
  • 4-Amino-2-nitroanisole
  • 4-Methoxy-3-nitroaniline
  • 3-Nitro-4-methoxyaniline
  • 3-Nitro-p-anisidine

Work with 4-Methoxy-3-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

2,4-Dinitroanisole119-27-767 % similar 1,4-Dimethoxy-2-nitrobenzene89-39-467 % similar 1-Methoxy-4-methyl-2-nitrobenzene119-10-865 % similar 4-Bromo-1-methoxy-2-nitrobenzene33696-00-363 % similar 4-Chloro-1-methoxy-2-nitrobenzene89-21-463 % similar Nitro-P-phenylenediamine5307-14-263 % similar 2,5-Dimethoxy-4-nitrobenzenamine6313-37-762 % similar 3,4-Dinitroaniline610-41-362 % similar

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

Same formula

2-Methoxy-6-methyl-3-nitropyridine112163-03-8 2,4-Dihydroxybenzhydrazide13221-86-8 3,5-Dimethyl-4-nitropyridine 1-oxide14248-66-9 5-Methoxy-2-nitrobenzenamine16133-49-6 2-Methoxy-6-nitrobenzenamine16554-45-3 4-Ethoxy-3-nitropyridine1796-84-5 5-Amino-2-methoxy-4-pyridinecarboxylic acid183741-91-5 2-Ethoxy-5-nitropyridine31594-45-3

Elsewhere

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