Urea, 3-(4-tert-butylcyclohexyl)-1-(2-chloroethyl)-1-nitroso-, trans-

Base Information

• Chemical Name: Urea, 3-(4-tert-butylcyclohexyl)-1-(2-chloroethyl)-1-nitroso-, trans-
• CAS No.: 13991-73-6
• Molecular Formula: C13H24ClN3O2
• Molecular Weight: 289.8016
• NSC Number: 95439
• DSSTox Substance ID: DTXSID50161195
• Nikkaji Number: J83.828D
• ChEMBL ID: CHEMBL12827,CHEMBL3276030

Synonyms:13991-73-6;Urea, 3-(4-tert-butylcyclohexyl)-1-(2-chloroethyl)-1-nitroso-, trans-;NSC 95439;NSC95439;trans-1-(4-tert-Butylcyclohexyl)-3-(2-chloroethyl)-3-nitrosourea;trans-3-(4-tert-Butylcyclohexyl)-1-(2-chloroethyl)-1-nitrosourea;Urea, 1-(4-tert-butylcyclohexyl)-3-(2-chloroethyl)-3-nitroso-, E-;trans-N-(2-Chloroethyl)-N'-(4-(1,1-dimethylethyl)cyclohexyl)-N-nitrosourea;CHEMBL12827;CHEMBL3276030;DTXSID50161195;NSC-95439;Urea, N-(2-chloroethyl)-N'-(4-(1,1-dimethylethyl)cyclohexyl)-N-nitroso-, trans-;Urea,1-dimethylethyl)cyclohexyl]-N-nitroso-, trans-

Chemical Property of Urea, 3-(4-tert-butylcyclohexyl)-1-(2-chloroethyl)-1-nitroso-, trans-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.2g/cm³
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 289.1557047
• Heavy Atom Count: 19
• Complexity: 310

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C1CCC(CC1)NC(=O)N(CCCl)N=O

Technology Process of Urea, 3-(4-tert-butylcyclohexyl)-1-(2-chloroethyl)-1-nitroso-, trans-

There total 2 articles about Urea, 3-(4-tert-butylcyclohexyl)-1-(2-chloroethyl)-1-nitroso-, trans- 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:

trans-4-t-butylcyclohexylamine (2163-34-0) → C13H24ClN3O2 (13991-73-6)

Guidance literature:

Multi-step reaction with 2 steps

1: diethyl ether

2: NaNO₂, HCO₂H

With formic acid; sodium nitrite; In diethyl ether;

DOI:10.1021/jm00324a026

Reference yield:

1-(4-tert-Butyl-cyclohexyl)-3-(2-chloro-ethyl)-urea → C13H24ClN3O2 (13991-73-6)

Guidance literature:

With formic acid; sodium nitrite;

DOI:10.1021/jm00324a026

upstream raw materials:

trans-4-t-butylcyclohexylamine

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