Didodecyl sebacate

Base Information

• Chemical Name: Didodecyl sebacate
• CAS No.: 2432-88-4
• Molecular Formula: C34H66 O4
• Molecular Weight: 538.896
• Hs Code.: 2917131000
• European Community (EC) Number: 219-412-9
• DSSTox Substance ID: DTXSID20179065
• Nikkaji Number: J185.689H
• Wikidata: Q83049593
• Mol file: 2432-88-4.mol

Synonyms:Didodecyl sebacate;2432-88-4;EINECS 219-412-9;Decanedioic acid, didodecyl ester;Di-n-dodecyl sebacate;Sebacic acid didodecyl ester;SCHEMBL596179;decanedioic acid didodecyl ester;DTXSID20179065

Chemical Property of Didodecyl sebacate

Chemical Property:

• Vapor Pressure: 5.28E-11mmHg at 25°C
• Boiling Point: 522.2°Cat760mmHg
• Flash Point: 235°C
• PSA: 52.60000
• Density: 0.903g/cm³
• LogP: 11.03540
• XLogP3: 13.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 33
• Exact Mass: 538.49611058
• Heavy Atom Count: 38
• Complexity: 447

Purity/Quality:

99% ,98%,Electron Grade , ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCCCCCC

Technology Process of Didodecyl sebacate

There total 3 articles about Didodecyl sebacate 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: 81.0%

1,10-decanedioic acid (111-20-6,26776-29-4) + 1-dodecyl alcohol (112-53-8) → Di-n-dodecyl sebacate (2432-88-4)

Guidance literature:

With 1-hexadecyl-3-sulfo-1H-imidazol-3-ium chloride; In neat (no solvent); at 110 ℃; for 16h; Green chemistry;

DOI:10.3906/kim-1811-44

Reference yield: 43.0%

1-dodecyl alcohol (112-53-8) + dimethyl sebacate (106-79-6) → Di-n-dodecyl sebacate (2432-88-4)

Guidance literature:

With 1-hexadecyl-3-sulfo-1H-imidazol-3-ium chloride; In neat (no solvent); at 110 ℃; for 16h; Green chemistry;

DOI:10.3906/kim-1811-44

Reference yield:

→ Di-n-dodecyl sebacate (2432-88-4)

Guidance literature:

Sebacinsaeure, Dodecanol-(1), p-Toluolsulfonsaeure, Toluol (Azeotrope Destillation des W.);

DOI:10.1021/je60012a033

upstream raw materials:

1,10-decanedioic acid

1-dodecyl alcohol

dimethyl sebacate