N-Methyl-N'-(p-methoxyphenyl)-N-nitrosourea

Base Information

• Chemical Name: N-Methyl-N'-(p-methoxyphenyl)-N-nitrosourea
• CAS No.: 25355-59-3
• Molecular Formula: C9H11 N3 O3
• Molecular Weight: 209.205
• NSC Number: 409831
• UNII: 2HFP4B6OJF
• DSSTox Substance ID: DTXSID90180002
• Nikkaji Number: J59.500D
• Wikidata: Q83050500
• Mol file: 25355-59-3.mol

Synonyms:N-methyl-N'-(4-methoxyphenyl)-N-nitrosourea;N-methyl-N'-(p-methoxyphenyl)-N-nitrosourea

Chemical Property of N-Methyl-N'-(p-methoxyphenyl)-N-nitrosourea

Chemical Property:

• Density: 1.24g/cm³
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 209.08004122
• Heavy Atom Count: 15
• Complexity: 227

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C(=O)NC1=CC=C(C=C1)OC)N=O

Technology Process of N-Methyl-N'-(p-methoxyphenyl)-N-nitrosourea

There total 6 articles about N-Methyl-N'-(p-methoxyphenyl)-N-nitrosourea 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: 92.0%

N-methyl-N'-(p-methoxyphenyl)urea (21260-49-1) → N-methyl-N'-(p-methoxyphenyl)-N-nitrosourea (25355-59-3)

Guidance literature:

With sodium nitrite; In formic acid; at 0 - 5 ℃; for 0.5h;

Reference yield: 10.0%

N-methyl-N'-(p-methoxyphenyl)urea (21260-49-1) → N-methyl-N'-(p-methoxyphenyl)-N-nitrosourea (25355-59-3) + C9H11N3O3 (110396-89-9)

Guidance literature:

With isopentyl nitrite; In chloroform; at 0 - 5 ℃; for 10h;

Reference yield:

4-methoxy-aniline (104-94-9) → N-methyl-N'-(p-methoxyphenyl)-N-nitrosourea (25355-59-3)

Guidance literature:

Multi-step reaction with 2 steps

1: CHCl₃

2: aq. NaNO₂, HCO₂H

With formic acid; sodium nitrite; In chloroform;

DOI:10.1021/jm00342a010

upstream raw materials:

N-methyl-N'-(p-methoxyphenyl)urea

C₉H₁₁N₃O₃

4-methoxy-aniline

Downstream raw materials:

4-methoxy-aniline

Refernces

• 1、 Yoshida, Kitaro,Yano, Kazuyuki. "Kinetics and Mechanism of Decomposition of N-Methyl-N'-aryl-N-nitrosoureas and Related Compounds in Aqueous Buffer Solution". . p. 2200 - 2203. Retrieved 2007/10/02.