Diethyl 2-(2-quinolin-2-ylethyl)propanedioate

Base Information

• Chemical Name: Diethyl 2-(2-quinolin-2-ylethyl)propanedioate
• CAS No.: 47304-84-7
• Molecular Formula: C₁₈H₂₁NO₄
• Molecular Weight: 315.369
• NSC Number: 99394
• DSSTox Substance ID: DTXSID90295044
• Wikidata: Q82034719
• Mol file: 47304-84-7.mol

Synonyms:47304-84-7;diethyl 2-(2-quinolin-2-ylethyl)propanedioate;NSC99394;DTXSID90295044;NSC-99394

Chemical Property of Diethyl 2-(2-quinolin-2-ylethyl)propanedioate

Chemical Property:

• Vapor Pressure: 4.78E-08mmHg at 25°C
• Boiling Point: 443.1°Cat760mmHg
• Flash Point: 221.8°C
• Density: 1.157g/cm³
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 315.14705815
• Heavy Atom Count: 23
• Complexity: 381

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(CCC1=NC2=CC=CC=C2C=C1)C(=O)OCC

Technology Process of Diethyl 2-(2-quinolin-2-ylethyl)propanedioate

There total 5 articles about Diethyl 2-(2-quinolin-2-ylethyl)propanedioate 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:

2-methylquinoline (91-63-4) → Diethyl-2-(2-guinoyl)ethylmalonat (47304-84-7)

Guidance literature:

Multi-step reaction with 2 steps

2: dimethyl sulfate; sodium ethylate; ethanol

With ethanol; sodium ethanolate; dimethyl sulfate;

DOI:10.1021/ja01152a506

Reference yield:

β-N,N-dimethylaminoethylquinaldine (63487-23-0) + diethyl malonate (105-53-3) → Diethyl-2-(2-guinoyl)ethylmalonat (47304-84-7)

Guidance literature:

With ethanol; sodium ethanolate; dimethyl sulfate;

DOI:10.1021/ja01152a506

Reference yield:

2-vinylquinoline (772-03-2) + diethyl malonate (105-53-3) → Diethyl-2-(2-guinoyl)ethylmalonat (47304-84-7)

Guidance literature:

With ethanol; sodium ethanolate;

upstream raw materials:

2-vinylquinoline

diethyl malonate

β-N,N-dimethylaminoethylquinaldine

2-methylquinoline

Downstream raw materials:

4--buttersaeure