N-(4-Methoxyphenyl)-2-nitrobenzenamine

C₁₃H₁₂N₂O₃CAS 54381-13-4244.25 g/mol

Open in Covalent MOL file

Ether Nitro Secondary amine

Properties

Molecular formula: C₁₃H₁₂N₂O₃
Molar mass: 244.25 g/mol
Exact mass: 244.0848 Da
logP: 3.35Crippen estimate
Polar surface area: 64.4 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

54381-13-4

SMILES

COC1=CC=C(C=C1)NC2=CC=CC=C2[N+](=O)[O-]

InChIKey

JLIRPISIPQMEDU-UHFFFAOYSA-N

InChI

InChI=1S/C13H12N2O3/c1-18-11-8-6-10(7-9-11)14-12-4-2-3-5-13(12)15(16)17/h2-9,14H,1H3

Weigh it out

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Names and synonyms

1 names

N-(4-Methoxyphenyl)-2-nitroaniline

Work with N-(4-Methoxyphenyl)-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

2-Nitrodiphenylamine119-75-568 % similar 2,4′-Dinitrodiphenylamine612-36-267 % similar N-(4-Chlorophenyl)-2-nitrobenzenamine23008-56-263 % similar HC Orange 154381-08-763 % similar N-Methyl-2-nitrobenzenamine612-28-253 % similar O-Nitroanisole91-23-653 % similar 4-Nitroanisole100-17-451 % similar N-(4-Methoxyphenyl)aniline1208-86-250 % similar

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

Same formula

Benzyl 2-oxo-1,2-dihydropyridin-3-ylcarbamate147269-67-8

Elsewhere

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