Urea oxalate

Base Information

• Chemical Name: Urea oxalate
• CAS No.: 513-80-4
• Molecular Formula: C3H6N2O5
• Molecular Weight: 150.091
• Hs Code.: 2924199090
• European Community (EC) Number: 208-171-5
• DSSTox Substance ID: DTXSID70199298
• NSC Number: 3969
• Mol file: 513-80-4.mol

Synonyms:Urea oxalate;513-80-4;oxalic acid;urea;UREAOXALATE;Harnstoffoxalat;EINECS 208-171-5;SCHEMBL1314798;DTXSID70199298;NSC3969;NSC-3969;NS00080761

Chemical Property of Urea oxalate

Chemical Property:

• Vapor Pressure: 2.47E-12mmHg at 25°C
• Boiling Point: 522.9°C at 760 mmHg
• Flash Point: 270°C
• PSA: 143.71000
• LogP: -0.42000
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 150.02767130
• Heavy Atom Count: 10
• Complexity: 101

Purity/Quality:

98%min ^*data from raw suppliers

Urea oxalate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(=O)(C(=O)O)O.C(=O)(N)N

Technology Process of Urea oxalate

There total 2 articles about Urea oxalate 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:

oxalic acid (144-62-7,97993-78-7) + urea (57-13-6) → urea oxalate (513-80-4)

Guidance literature:

In neat (no solvent); for 1h; Milling;

DOI:10.1021/acs.joc.1c01817

Reference yield:

→ urea oxalate (513-80-4)

Guidance literature:

Hydrat: Harnstoff, Oxalsaeure;

upstream raw materials:

oxalic acid

urea

Refernces

• 1、 Kralj, Magdalena,Lukin, Stipe,Mileti?, Goran,Halasz, Ivan. "Using Desmotropes, Cocrystals, and Salts to Manipulate Reactivity in Mechanochemical Organic Reactions". . p. 14160 - 14168. Retrieved 2021/09/28.