Docosyl hydrogen fumarate

Base Information

• Chemical Name: Docosyl hydrogen fumarate
• CAS No.: 45302-46-3
• Molecular Formula: C₂₆H₄₈O₄
• Molecular Weight: 424.665
• European Community (EC) Number: 256-228-8
• DSSTox Substance ID: DTXSID101310865
• Mol file: 45302-46-3.mol

Synonyms:Docosyl hydrogen fumarate;45302-46-3;EINECS 256-228-8;Docosyl (2E)-2-butenedioate;SCHEMBL2831203;DTXSID101310865

Chemical Property of Docosyl hydrogen fumarate

Chemical Property:

• Vapor Pressure: 9.94E-13mmHg at 25°C
• Boiling Point: 531.8°Cat760mmHg
• Flash Point: 162.7°C
• Density: 0.944g/cm³
• XLogP3: 10.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 24
• Exact Mass: 424.35526001
• Heavy Atom Count: 30
• Complexity: 417

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCCOC(=O)C=CC(=O)O
• Isomeric SMILES: CCCCCCCCCCCCCCCCCCCCCCOC(=O)/C=C/C(=O)O

Technology Process of Docosyl hydrogen fumarate

There total 2 articles about Docosyl hydrogen fumarate 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:

→ docosyl hydrogen fumarate (2944-08-3,45302-46-3)

Guidance literature:

entspr. Anhydrid, Docosanol;

Reference yield:

maleic anhydride (108-31-6) + 1-docosanol (661-19-8) → docosyl maleate (45302-46-3)

Guidance literature:

In n-heptane; at 110 ℃; for 4h;

DOI:10.1016/j.tca.2015.10.015

upstream raw materials:

maleic anhydride

1-docosanol

Refernces