Urea, 1-(carbamoylmethyl)-3-(2-chloroethyl)-3-nitroso-

Base Information

• Chemical Name: Urea, 1-(carbamoylmethyl)-3-(2-chloroethyl)-3-nitroso-
• CAS No.: 65267-04-1
• Molecular Formula: C5H9ClN4O3
• Molecular Weight: 208.603
• NSC Number: 356549
• DSSTox Substance ID: DTXSID90215585
• Nikkaji Number: J597.721E
• Wikidata: Q83091645
• ChEMBL ID: CHEMBL167757

Synonyms:65267-04-1;Urea, 1-(carbamoylmethyl)-3-(2-chloroethyl)-3-nitroso-;NIOSH/AB5625000;AB56250000;N-(2-Chloroethyl)-N-nitrosocarbamoyl-glycinamide;Acetamide, 2-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-;CCRIS 3035;BRN 1971074;1-(Carbamoylmethyl)-3-(2-chloroethyl)-3-nitrosourea;CHEMBL167757;SCHEMBL11060668;DTXSID90215585;NSC356549;NSC 356549;NSC-356549;2-({[(2-chloroethyl)(nitroso)amino]carbonyl}amino)acetamide

Chemical Property of Urea, 1-(carbamoylmethyl)-3-(2-chloroethyl)-3-nitroso-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.58g/cm³
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 208.0363179
• Heavy Atom Count: 13
• Complexity: 210

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CCl)N(C(=O)NCC(=O)N)N=O

Technology Process of Urea, 1-(carbamoylmethyl)-3-(2-chloroethyl)-3-nitroso-

There total 4 articles about Urea, 1-(carbamoylmethyl)-3-(2-chloroethyl)-3-nitroso- 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: 73.0%

p-nitrophenyl N-(2-chloroethyl)-N-nitroso-carbamate (55661-43-3) + H-Gly-NH2 (598-41-4) → N-glycinamide (65267-04-1)

Guidance literature:

In tetrahydrofuran; methanol; for 0.5h;

DOI:10.1021/jm00349a012

Reference yield: 50.0%

N-(2-chloroethyl)-N-nitrosocarbamic acid N-hydroxypyrrolidine-2,5-dione ester (80354-49-0) + H-Gly-NH2 (598-41-4) → N-glycinamide (65267-04-1)

Guidance literature:

DOI:10.1002/jps.2600830714

Reference yield: 40.0%

N1-(2-chloroethyl)-N1-nitrosocarbamoyl azide (60784-40-9) + glycinamide hydrochloride (1668-10-6) → N-glycinamide (65267-04-1)

Guidance literature:

In isopropyl alcohol;

upstream raw materials:

p-nitrophenyl N-(2-chloroethyl)-N-nitroso-carbamate

H-Gly-NH₂

N-(2-chloroethyl)-N-nitrosocarbamic acid N-hydroxypyrrolidine-2,5-dione ester

N₁-(2-chloroethyl)-N₁-nitrosocarbamoyl azide

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