Diethyl 1,4,5,6,7,8-hexahydro-5-oxo-3,4-quinolinedicarboxylate

Base Information

• Chemical Name: Diethyl 1,4,5,6,7,8-hexahydro-5-oxo-3,4-quinolinedicarboxylate
• CAS No.: 131929-07-2
• Molecular Formula: C15H19NO5
• Molecular Weight: 293.3151
• DSSTox Substance ID: DTXSID80927408

Synonyms:BRN 4756692;Diethyl 1,4,5,6,7,8-hexahydro-5-oxo-3,4-quinolinedicarboxylate;3,4-Quinolinedicarboxylic acid, 1,4,5,6,7,8-hexahydro-5-oxo-, diethyl ester;131929-07-2;DTXSID80927408;LS-141803;Diethyl 5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,4-dicarboxylate

Chemical Property of Diethyl 1,4,5,6,7,8-hexahydro-5-oxo-3,4-quinolinedicarboxylate

Chemical Property:

• Vapor Pressure: 7.48E-08mmHg at 25°C
• Boiling Point: 437.4°C at 760 mmHg
• Flash Point: 218.3°C
• Density: 1.24g/cm³
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 293.12632271
• Heavy Atom Count: 21
• Complexity: 532

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1C(=CNC2=C1C(=O)CCC2)C(=O)OCC

Technology Process of Diethyl 1,4,5,6,7,8-hexahydro-5-oxo-3,4-quinolinedicarboxylate

There total 1 articles about Diethyl 1,4,5,6,7,8-hexahydro-5-oxo-3,4-quinolinedicarboxylate 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: 45.0%

3-(4α-N,N-dimethylaminomethylene)amino-2-cyclohexen-1-one (727654-69-5) + Diethyl maleate (141-05-9) → 3,4-diethoxycarbonyl-1,4,5,6,7,8-hexahydroquinol-5-one (131929-07-2)

Guidance literature:

In xylene; for 6h; Heating;

DOI:10.1007/BF00767027

upstream raw materials:

3-(4α-N,N-dimethylaminomethylene)amino-2-cyclohexen-1-one

Diethyl maleate

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