N-Methyl-N-(4-methyl-2,6-dinitrophenyl)nitrous amide

Base Information

• Chemical Name: N-Methyl-N-(4-methyl-2,6-dinitrophenyl)nitrous amide
• CAS No.: 113242-94-7
• Molecular Formula: C8H8N4O5
• Molecular Weight: 240.175
• DSSTox Substance ID: DTXSID00552776
• Wikidata: Q82433151
• Mol file: 113242-94-7.mol

Synonyms:113242-94-7;N-Methyl-N-(4-methyl-2,6-dinitrophenyl)nitrous amide;SCHEMBL10795972;DTXSID00552776

Chemical Property of N-Methyl-N-(4-methyl-2,6-dinitrophenyl)nitrous amide

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 1
• Exact Mass: 240.04946937
• Heavy Atom Count: 17
• Complexity: 301

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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

Technology Process of N-Methyl-N-(4-methyl-2,6-dinitrophenyl)nitrous amide

There total 15 articles about N-Methyl-N-(4-methyl-2,6-dinitrophenyl)nitrous amide 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:

4,N,N-trimethyl-2,6-dinitro-aniline (51226-43-8) + acetic acid (64-19-7,77671-22-8) → 4-methyl-2,6-dinitroaniline (6393-42-6) + N,4-dimethyl-2,6-dinitroaniline (51422-10-7) + 4,N-dimethyl-2,6-dinitro-N-nitroso-aniline (113242-94-7) + 4,N-dimethyl-2,6,N-trinitro-aniline (62323-65-3)

Guidance literature:

Reference yield:

4,N-dimethyl-2,6,N-trinitro-aniline (62323-65-3) → 4,N-dimethyl-2,6-dinitro-N-nitroso-aniline (113242-94-7)

Guidance literature:

With sulfuric acid; at -10 ℃;

Reference yield:

N-methyl-p-toluidine (623-08-5) → 4,N-dimethyl-2-nitroaniline (4600-08-2) + 4,N-dimethyl-2,6-dinitro-N-nitroso-aniline (113242-94-7)

Guidance literature:

With nitric acid; acetic acid; at 100 ℃; anfangs bei Zimmertemperatur;

upstream raw materials:

N-methyl-N-nitroso-p-toluidine

4,N,N-trimethyl-2,6-dinitro-aniline

N-methyl-p-toluidine

4,N,N-trimethyl-2-nitroaniline

Downstream raw materials:

4,N-dimethyl-2,6,N-trinitro-aniline

N,4-dimethyl-2,6-dinitroaniline