5,10-Dioxo-5H,10H-diimidazo(1,5-a:1',5'-d)pyrazine-1,6-dicarbonyl dichloride

Base Information

• Chemical Name: 5,10-Dioxo-5H,10H-diimidazo(1,5-a:1',5'-d)pyrazine-1,6-dicarbonyl dichloride
• CAS No.: 59157-06-1
• Molecular Formula: C10H2Cl2N4O4
• Molecular Weight: 313.056
• European Community (EC) Number: 261-632-2
• DSSTox Substance ID: DTXSID70974582
• Nikkaji Number: J133.167A
• Wikidata: Q82958975
• Mol file: 59157-06-1.mol

Synonyms:EINECS 261-632-2;5,10-Dioxo-5H,10H-diimidazo(1,5-a:1',5'-d)pyrazine-1,6-dicarbonyl dichloride;59157-06-1;5,10-dioxo-5H,10H-diimidazo[1,5-a:1',5'-d]pyrazine-1,6-dicarbonyl dichloride;C10H2Cl2N4O4;SCHEMBL2735396;DTXSID70974582;C10-H2-Cl2-N4-O4;5,10-Dioxo-5H,10H-diimidazo[1,5-a:1',5'-d]pyrazine-1,6-dicarbonyl chloride

Chemical Property of 5,10-Dioxo-5H,10H-diimidazo(1,5-a:1',5'-d)pyrazine-1,6-dicarbonyl dichloride

Chemical Property:

• Boiling Point: 729.7°Cat760mmHg
• Flash Point: 395.1°C
• PSA: 102.88000
• Density: 2.13g/cm³
• LogP: -0.10180
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 311.9453099
• Heavy Atom Count: 20
• Complexity: 481

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=NC(=C2N1C(=O)C3=C(N=CN3C2=O)C(=O)Cl)C(=O)Cl

Technology Process of 5,10-Dioxo-5H,10H-diimidazo(1,5-a:1',5'-d)pyrazine-1,6-dicarbonyl dichloride

There total 2 articles about 5,10-Dioxo-5H,10H-diimidazo(1,5-a:1',5'-d)pyrazine-1,6-dicarbonyl dichloride 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:

4,5-imidazoledicarboxylic acid (570-22-9) → 4H,9H-diimidazo<1,5-a; 1',5'-d>pyrazine-5,10-dione-1,6-dicarboxylic dichloride (59157-06-1)

Guidance literature:

With thionyl chloride; N,N-dimethyl-formamide; In benzene; for 16h; Heating;

DOI:10.1021/jo025536c

Reference yield:

→ 4H,9H-diimidazo<1,5-a; 1',5'-d>pyrazine-5,10-dione-1,6-dicarboxylic dichloride (59157-06-1)

Guidance literature:

Imidazol-4,5-dicarbonsaeure-Na-Salz, Thionylchlorid, Erwaermen;

Reference yield: 93.0%

4H,9H-diimidazo<1,5-a; 1',5'-d>pyrazine-5,10-dione-1,6-dicarboxylic dichloride (59157-06-1) + L-alanine benzyl ester hydrochloride (5557-81-3,5557-83-5,34404-37-0) → C30H26N6O8 (1162645-90-0)

Guidance literature:

With N,N-diethylaniline; In dichloromethane; at -78 - 20 ℃; for 1.5h;

DOI:10.3390/molecules13123149

upstream raw materials:

4,5-imidazoledicarboxylic acid

Downstream raw materials:

5,10-dioxo-N¹,N⁶-diphenyl-5,10-dihydrodiimidazo[1,5-a:1',5'-d]pyrazine-1,6-dicarboxamide

1H-imidazole-4,5-dicarboxylic acid bis-benzylamide

1H-imidazole-4,5-dicarboxylic acid bis-butylamide

5,10-dioxo-5H,10H-diimidazolo[1,5-a:1',5'-d]pyrazine-1,6-dicarboxylic acid diphenyl ester