4-Methyl-N-(4-methyl-2-nitrophenyl)-2-nitroaniline

Base Information

• Chemical Name: 4-Methyl-N-(4-methyl-2-nitrophenyl)-2-nitroaniline
• CAS No.: 65712-02-9
• Molecular Formula: C14H13N3O4
• Molecular Weight: 287.275
• DSSTox Substance ID: DTXSID70497564
• Wikidata: Q82347198

Synonyms:4-Methyl-N-(4-methyl-2-nitrophenyl)-2-nitroaniline;65712-02-9;DTXSID70497564

Chemical Property of 4-Methyl-N-(4-methyl-2-nitrophenyl)-2-nitroaniline

Chemical Property:

• XLogP3: 4.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 287.09060590
• Heavy Atom Count: 21
• Complexity: 357

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1)NC2=C(C=C(C=C2)C)[N+](=O)[O-])[N+](=O)[O-]

Technology Process of 4-Methyl-N-(4-methyl-2-nitrophenyl)-2-nitroaniline

There total 9 articles about 4-Methyl-N-(4-methyl-2-nitrophenyl)-2-nitroaniline which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 89.0%

di-p-tolylamine (620-93-9) → bis(4-methyl-2-nitrophenyl)amine (65712-02-9)

Guidance literature:

With nitric acid; acetic acid; isopentyl nitrite; at 0 ℃; for 0.416667h;

DOI:10.1021/acs.inorgchem.5b01380

Reference yield:

N,N-di-p-tolyl-hydroxylamine (116043-88-0) → bis(4-methyl-2-nitrophenyl)amine (65712-02-9)

Guidance literature:

With diethyl ether; Nitrogen dioxide; benzene;

Reference yield:

N,N-Bis(4-methylphenyl)benzamid (87995-57-1) → bis(4-methyl-2-nitrophenyl)amine (65712-02-9)

Guidance literature:

With nitric acid; man zerlegt das durch Wasser gefaellte Reaktionsprodukt mit alkoh.Kalilauge;

upstream raw materials:

N,N-di-p-tolyl-hydroxylamine

N,N-Bis(4-methylphenyl)benzamid

di-p-tolylamine

nitric acid

Downstream raw materials:

bis(2-amino-4-methylphenyl)amine

5-acetyl-5,10-dihydro-2,8-dimethyl-10-(4-nitrophenyl)phenazine

bis-(2-acetylamino-4-methyl-phenyl)-amine

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