Acetamide, N-(aminocarbonyl)-2-cyano-

Base Information

• Chemical Name: Acetamide, N-(aminocarbonyl)-2-cyano-
• CAS No.: 1448-98-2
• Molecular Formula: C4H5 N3 O2
• Molecular Weight: 127.103
• Hs Code.: 29242100
• European Community (EC) Number: 215-906-3
• NSC Number: 6287
• UNII: M3689A6A46
• DSSTox Substance ID: DTXSID7061697
• Nikkaji Number: J42.332G
• Wikidata: Q72457839
• Mol file: 1448-98-2.mol

Synonyms:Cyanoacetylurea;1448-98-2;N-Carbamoyl-2-cyanoacetamide;Acetamide, N-(aminocarbonyl)-2-cyano-;(Cyanoacetyl)urea;2-Cyanoacetylurea;N-(2-Cyanoacetyl)urea;Urea, (cyanoacetyl)-;(2-cyanoacetyl)urea;1-(Cyanoacetyl)urea;AI3-28760;NSC-6287;EINECS 215-906-3;NSC6287;N-(aminocarbonyl)-2-cyanoacetamide;Cyanoacetylurea, 97%;N-(Cyanoacetyl)urea #;1-(2-Cyanoacetyl)urea;SCHEMBL670466;DTXSID7061697;NSC 6287;STR09430;MFCD00007947;STL197509;AKOS000200379;M3689A6A46;FT-0624129;EN300-17126;D97656;Z56889028

Chemical Property of Acetamide, N-(aminocarbonyl)-2-cyano-

Chemical Property:

• Melting Point: 215°C (dec.)
• Boiling Point: °Cat760mmHg
• PKA: 4.51±0.10(Predicted)
• Flash Point: °C
• PSA: 95.98000
• Density: 1.342 g/cm³
• LogP: 0.18618
• Storage Temp.: Store below +30°C.
• Solubility.: DMSO
• XLogP3: -0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 127.038176411
• Heavy Atom Count: 9
• Complexity: 178

Purity/Quality:

99.9% ^*data from raw suppliers

Cyanoacetylurea ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 25-36/37/38-20/21/22
• Safety Statements: 20-26-36/37-45-60-37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C#N)C(=O)NC(=O)N
• Uses: Cyanoacetylurea is an intermediate in synthesizing Uridine (U829910), a nucleoside widely distributed in nature. Uridine is one of the four basic components of ribonucleic acid (RNA)

Technology Process of Acetamide, N-(aminocarbonyl)-2-cyano-

There total 10 articles about Acetamide, N-(aminocarbonyl)-2-cyano- 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:

cyanoacetic acid (372-09-8) + urea (57-13-6) → uric Acid (69-93-2) + N-(aminocarbonyl)-2-cyano-acetamide (1448-98-2)

Guidance literature:

Reference yield:

cyanoacetic acid (372-09-8) + urea (57-13-6) → N-(aminocarbonyl)-2-cyano-acetamide (1448-98-2)

Guidance literature:

With acetic anhydride;

Reference yield:

ethyl 2-cyanoacetate (105-56-6) + urea (57-13-6) → N-(aminocarbonyl)-2-cyano-acetamide (1448-98-2)

Guidance literature:

With magnesium methanolate; at 65 - 70 ℃;

upstream raw materials:

acetic anhydride

cyanoacetic acid

urea

ethyl 2-cyanoacetate

Downstream raw materials:

2,4-Dioxo-6-imino-1,3-diaza-hexahydrobenzol

2-phenylazo-2-phenylhydrazonoacetonitrile

4-Amino-2,6-dihydroxypyrimidine

uracil