chempirical

N-Methyl-2-nitrobenzenamine

C7H8N2O2CAS 612-28-2152.15 g/mol

Open in Covalent MOL file
HNN+OO−
NitroSecondary amine

Properties

Molecular formula
C7H8N2O2
Molar mass
152.15 g/mol
Exact mass
152.0586 Da
Melting point
38 °C
Boiling point
158 °C
logP
1.64Crippen estimate
Polar surface area
55.2 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2

Identifiers

CAS number
612-28-2
SMILES
CNc1ccccc1[N+](=O)[O-]
InChIKey
KFBOUJZFFJDYTA-UHFFFAOYSA-N
InChI
InChI=1S/C7H8N2O2/c1-8-6-4-2-3-5-7(6)9(10)11/h2-5,8H,1H3

Weigh it out

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

Names and synonyms

11 names
  • Benzenamine, N-methyl-2-nitro-
  • Aniline, N-methyl-o-nitro-
  • o-Nitro-N-methylaniline
  • N-Methyl-o-nitroaniline
  • o-(Methylamino)nitrobenzene
  • N-Methyl-2-nitroaniline
  • 2-Nitro-N-methylaniline
  • 2-(Methylamino)nitrobenzene
  • NSC 86672
  • (Methyl)(2-nitrophenyl)amine
  • 4-(N-Methylamino)-3-nitrobenzene

Work with N-Methyl-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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(2-Nitrophenyl)hydrazine3034-19-365 % similar 2-Nitrodiphenylamine119-75-561 % similar 1,2-Dinitrobenzene528-29-059 % similar o-Nitrophenylhydrazine hydrochloride6293-87-459 % similar 2,4′-Dinitrodiphenylamine612-36-256 % similar Hc yellow 24926-55-054 % similar 2-Nitrotoluene88-72-253 % similar Nitrophenol88-75-553 % similar

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

Same formula

N-Methyl-4-nitroaniline100-15-2 4-Methyl-3-nitroaniline119-32-4 Methyl 2-aminopyridine-3-carboxylate14667-47-1 2,6-Dimethyl-3-nitropyridine15513-52-7 4,6-Dimethyl-5-pyrimidinecarboxylic acid157335-93-8 6-Amino-4-methyl-3-pyridinecarboxylic acid179555-11-4 N-(Hydroxymethyl)nicotinamide3569-99-1 Methyl 3-amino-2-pyridinecarboxylate36052-27-4

Elsewhere

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