chempirical

5-Methoxy-2-nitrobenzenamine

C7H8N2O3CAS 16133-49-6168.15 g/mol

Open in Covalent MOL file
ON+OO−NH2
EtherNitroPrimary amine

Properties

Molecular formula
C7H8N2O3
Molar mass
168.15 g/mol
Exact mass
168.0535 Da
Melting point
131 °C
logP
1.19Crippen estimate
Polar surface area
78.4 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
2

Identifiers

CAS number
16133-49-6
SMILES
COc1ccc([N+](=O)[O-])c(N)c1
InChIKey
QEHVRGACCVLLNN-UHFFFAOYSA-N
InChI
InChI=1S/C7H8N2O3/c1-12-5-2-3-7(9(10)11)6(8)4-5/h2-4H,8H2,1H3

Weigh it out

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Names and synonyms

6 names
  • Benzenamine, 5-methoxy-2-nitro-
  • m-Anisidine, 6-nitro-
  • 5-Methoxy-2-nitroaniline
  • 2-Nitro-5-methoxyaniline
  • (5-Methoxy-2-nitrophenyl)amine
  • 3-Methoxy-6-nitroaniline

Work with 5-Methoxy-2-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

4-Methoxy-2-nitroaniline96-96-879 % similar 2,4-Dimethoxy-1-nitrobenzene4920-84-771 % similar 3-Methyl-4-nitroanisole5367-32-869 % similar 5-Methoxy-2-nitrophenol704-14-367 % similar 1,4-Dimethoxy-2-nitrobenzene89-39-466 % similar 4-Methoxy-1-methyl-2-nitrobenzene17484-36-564 % similar 5-Methyl-2-nitroaniline578-46-163 % similar 1-Chloro-4-methoxy-2-nitrobenzene10298-80-362 % 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 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 2,3-Dimethyl-4-nitropyridine N-oxide37699-43-7

Elsewhere

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