Diethyl 2,6-dimethyleneheptanedioate

Base Information

• Chemical Name: Diethyl 2,6-dimethyleneheptanedioate
• CAS No.: 69565-07-7
• Molecular Formula: C13H20 O4
• Molecular Weight: 240.299
• European Community (EC) Number: 274-043-0
• DSSTox Substance ID: DTXSID20989601
• Nikkaji Number: J318.003D
• Wikidata: Q82978788
• Mol file: 69565-07-7.mol

Synonyms:Diethyl 2,6-dimethyleneheptanedioate;69565-07-7;EINECS 274-043-0;diethyl 2,6-dimethylideneheptanedioate;SCHEMBL7983922;DTXSID20989601;2,6-Dimethyleneheptanedioic acid diethyl ester

Chemical Property of Diethyl 2,6-dimethyleneheptanedioate

Chemical Property:

• Vapor Pressure: 0.000211mmHg at 25°C
• Boiling Point: 326.8°C at 760 mmHg
• Flash Point: 155.1°C
• PSA: 52.60000
• Density: 1.001g/cm³
• LogP: 2.39530
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 10
• Exact Mass: 240.13615911
• Heavy Atom Count: 17
• Complexity: 275

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(=C)CCCC(=C)C(=O)OCC

Technology Process of Diethyl 2,6-dimethyleneheptanedioate

There total 2 articles about Diethyl 2,6-dimethyleneheptanedioate 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:

formaldehyd (50-00-0,30525-89-4,61233-19-0) + pentane-1,1,5,5-tetracarboxylic acid-1,5-diethyl ester (91907-06-1) → 2,6-dimethylene-heptanedioic acid diethyl ester (69565-07-7)

Guidance literature:

With water; dimethyl amine;

DOI:10.1021/ja01578a048

Reference yield:

→ 2,6-dimethylene-heptanedioic acid diethyl ester (69565-07-7)

Guidance literature:

entspr. Pimelat (3);

upstream raw materials:

formaldehyd

pentane-1,1,5,5-tetracarboxylic acid-1,5-diethyl ester