N-Methyl-N-(2-oxocyclohexyl)nitrous amide

Base Information

• Chemical Name: N-Methyl-N-(2-oxocyclohexyl)nitrous amide
• CAS No.: 116203-82-8
• Molecular Formula: C7H12N2O2
• Molecular Weight: 156.184
• DSSTox Substance ID: DTXSID50557190
• Mol file: 116203-82-8.mol

Synonyms:N-Methyl-N-(2-oxocyclohexyl)nitrous amide;116203-82-8;DTXSID50557190

Chemical Property of N-Methyl-N-(2-oxocyclohexyl)nitrous amide

Chemical Property:

• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 156.089877630
• Heavy Atom Count: 11
• Complexity: 170

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C1CCCCC1=O)N=O

Technology Process of N-Methyl-N-(2-oxocyclohexyl)nitrous amide

There total 2 articles about N-Methyl-N-(2-oxocyclohexyl)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: 74.0%

C7H14N2O2 (116203-84-0) → N-nitrosomethyl-N-2-oxocyclohexylamine (116203-82-8)

Guidance literature:

With chromium(VI) oxide; florisil; In ethyl acetate; at 25 ℃; for 0.333333h;

Reference yield:

cis-2-(N-methyl)amino-1-cyclohexanol (20431-81-6,20431-83-8,21651-83-2,21651-84-3,62624-56-0,92142-06-8,92344-45-1,112708-89-1) → N-nitrosomethyl-N-2-oxocyclohexylamine (116203-82-8)

Guidance literature:

With potassium permanganate; acetic acid; sodium nitrite; Yield given. Multistep reaction; 1.) 25 deg C, 2,5 h, 2.) 25 deg C, 2 h;

Reference yield: 69.0%

N-nitrosomethyl-N-2-oxocyclohexylamine (116203-82-8) + methyl iodide (74-88-4) → N-nitrosomethyl-N-methyl-2-oxocyclohexylamine (126630-59-9)

Guidance literature:

With sodium hydroxide; sodium carbonate; In N,N-dimethyl-formamide; Yields of byproduct given. Title compound not separated from byproducts; Ambient temperature;

upstream raw materials:

cis-2-(N-methyl)amino-1-cyclohexanol

C₇H₁₄N₂O₂

Downstream raw materials:

N-nitrosomethyl-N-methyl-2-oxocyclohexylamine

Refernces

• 1、 Saavedra, Joseph E.,Farnsworth, David W.,Pei, Guo-Kui. "OXIDATION OF β-HYDROXYNITROSAMINES AND β-HYDROXYNITROSOUREAS TO THE CORRESPONDING β-OXO DERIVATIVES WITH CrO3/CELITE OR CrO3/FLORISIL IN NON-AQUEOUS MEDIA". . p. 313 - 322. Retrieved 2007/10/02.