2,5-Diallylhexanedioic acid

Base Information

• Chemical Name: 2,5-Diallylhexanedioic acid
• CAS No.: 6339-65-7
• Molecular Formula: C12H18O4
• Molecular Weight: 226.2689
• NSC Number: 38091
• DSSTox Substance ID: DTXSID90979559
• Mol file: 6339-65-7.mol

Synonyms:2,5-Diallylhexanedioic acid;6339-65-7;NSC 38091;NSC38091;2,5-di(prop-2-en-1-yl)hexanedioic acid;DTXSID90979559;NSC-38091

Chemical Property of 2,5-Diallylhexanedioic acid

Chemical Property:

• Vapor Pressure: 1.17E-07mmHg at 25°C
• Boiling Point: 404°Cat760mmHg
• Flash Point: 212.3°C
• Density: 1.094g/cm³
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 226.12050905
• Heavy Atom Count: 16
• Complexity: 242

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCC(CCC(CC=C)C(=O)O)C(=O)O

Technology Process of 2,5-Diallylhexanedioic acid

There total 3 articles about 2,5-Diallylhexanedioic acid 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:

ethyl-bis-1,3-(2-propenyl)-2-oxo-cyclopentanecarboxylate (99423-53-7) → Diallyladipinsaeure (6339-65-7)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium ethylate; ethanol

With ethanol; sodium ethanolate;

DOI:10.1021/ja01575a044

Reference yield:

2,5-diallyl-adipic acid diethyl ester (6337-30-0) → Diallyladipinsaeure (6339-65-7)

Guidance literature:

DOI:10.1021/ja01575a044

Reference yield:

C18H34O4Si2 → Diallyladipinsaeure (6339-65-7)

Guidance literature:

With water; Yield given;

DOI:10.1016/S0040-4039(00)74801-5

upstream raw materials:

2,5-diallyl-adipic acid diethyl ester

ethyl-bis-1,3-(2-propenyl)-2-oxo-cyclopentanecarboxylate