5,5-Diethyl-1-(2-hydroxypropyl)barbituric acid

Base Information

• Chemical Name: 5,5-Diethyl-1-(2-hydroxypropyl)barbituric acid
• CAS No.: 7548-62-1
• Molecular Formula: C11H18N2O4
• Molecular Weight: 242.2716
• DSSTox Substance ID: DTXSID10996940
• Mol file: 7548-62-1.mol

Synonyms:BRN 0665682;5,5-Diethyl-1-(2-hydroxypropyl)barbituric acid;7548-62-1;BARBITURIC ACID, 5,5-DIETHYL-1-(2-HYDROXYPROPYL)-;DTXSID10996940;LS-24168;5,5-Diethyl-6-hydroxy-3-(2-hydroxypropyl)pyrimidine-2,4(3H,5H)-dione

Chemical Property of 5,5-Diethyl-1-(2-hydroxypropyl)barbituric acid

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.161g/cm³
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 242.12665706
• Heavy Atom Count: 17
• Complexity: 349

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1(C(=O)NC(=O)N(C1=O)CC(C)O)CC

Technology Process of 5,5-Diethyl-1-(2-hydroxypropyl)barbituric acid

There total 1 articles about 5,5-Diethyl-1-(2-hydroxypropyl)barbituric acid 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: 100.0%

diethylbarbituric acid (57-44-3) + methyloxirane (75-56-9,16033-71-9) → N-(2-hydroxypropyl) 5,5-diethylbarbiturate (7548-62-1)

Guidance literature:

With triethylamine; N,N-dimethyl-formamide; for 23h; Heating;

DOI:10.1515/HC.2008.14.3.199

upstream raw materials:

diethylbarbituric acid

methyloxirane