5-Oxopyrrolidine-3-carboxamide

Base Information

• Chemical Name: 5-Oxopyrrolidine-3-carboxamide
• CAS No.: 14466-21-8
• Molecular Formula: C₅H₈N₂O₂
• Molecular Weight: 128.131
• Hs Code.: 2933790090
• European Community (EC) Number: 692-258-1
• DSSTox Substance ID: DTXSID00393348
• Mol file: 14466-21-8.mol

Synonyms:5-OP-CA;5-oxopyrrolidine-3-carboxamide

Chemical Property of 5-Oxopyrrolidine-3-carboxamide

Chemical Property:

• PSA: 72.19000
• LogP: -0.36310
• Storage Temp.: 2-8°C
• XLogP3: -1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 128.058577502
• Heavy Atom Count: 9
• Complexity: 155

Purity/Quality:

98%,99%, ^*data from raw suppliers

5-Oxopyrrolidine-3-carboxamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1C(CNC1=O)C(=O)N

Technology Process of 5-Oxopyrrolidine-3-carboxamide

There total 2 articles about 5-Oxopyrrolidine-3-carboxamide 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:

Dimethyl itakonate (617-52-7) → 5-oxopyrrolidine-3-carboxamide (14466-21-8)

Guidance literature:

With methanol; ammonia;

Reference yield:

→ 5-oxopyrrolidine-3-carboxamide (14466-21-8)

Guidance literature:

Diethylitaconat, NH3-Gas, A.;

Reference yield: 33.0%

5-oxopyrrolidine-3-carboxamide (14466-21-8) + (2,6-dimethylphenyl)(phenyl)iodonium triflate (1449510-53-5) → 1-(2,6-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide

Guidance literature:

5-oxopyrrolidine-3-carboxamide; With sodium hydride; In tetrahydrofuran; hexane; at 0 - 20 ℃; for 1h; Inert atmosphere; Schlenk technique;

(2,6-dimethylphenyl)(phenyl)iodonium triflate; In N,N-dimethyl-formamide; at 100 ℃; for 16h;

DOI:10.1002/anie.201606599

upstream raw materials:

Dimethyl itakonate

Refernces