Trimethylolpropane trilaurate

Base Information

• Chemical Name: Trimethylolpropane trilaurate
• CAS No.: 25268-73-9
• Molecular Formula: C42H80 O6
• Molecular Weight: 681.094
• Hs Code.: 2915900090
• European Community (EC) Number: 246-777-1
• UNII: 08S3S2V8PP
• DSSTox Substance ID: DTXSID001014848
• Nikkaji Number: J236.110H
• Wikidata: Q27236419
• Mol file: 25268-73-9.mol

Synonyms:Trimethylolpropane trilaurate;25268-73-9;2,2-bis(dodecanoyloxymethyl)butyl dodecanoate;UNII-08S3S2V8PP;08S3S2V8PP;EINECS 246-777-1;1,1,1-Trimethylolpropane, trilaurate;2-ethyl-2-[[(1-oxododecyl)oxy]methyl]propane-1,3-diyl dilaurate;Dodecanoic acid, 2-ethyl-2-(((oxododecyl)oxy)methyl)-1,3-propanediyl ester;Dodecanoic acid, 2-ethyl-2-(((1-oxododecyl)oxy)methyl)-1,3-propanediyl ester;Dodecanoic acid, 1,1'-(2-ethyl-2-(((1-oxododecyl)oxy)methyl)-1,3-propanediyl) ester;2-Ethyl-2-(((1-oxododecyl)oxy)methyl)propane-1,3-diyl dilaurate;Dodecanoic acid, 2-ethyl-2-[[(1-oxododecyl)oxy]methyl]-1,3-propanediyl ester;TRIOXENE T;SCHEMBL8539661;DTXSID001014848;C42H80O6;TRIMETHYLOLPROPANE TRILAURATE [INCI];Q27236419;2- ethyl- 2- [[(1- oxododecyl)oxy]methyl]propane- 1, 3- diyl dilaurate;2-Ethyl-2-(((1-oxododecyl)oxy)methyl)-1,3-propanediyl didodecanoate;LAURIC ACID, TRIESTER WITH 2-ETHYL-2-(HYDROXYETHYL)-1,3-PROPANEDIOL;Bisdodecanoic acid 2-ethyl-2-[[(1-oxododecyl)oxy]methyl]-1,3-propanediyl ester

Chemical Property of Trimethylolpropane trilaurate

Chemical Property:

• Vapor Pressure: 5.78E-19mmHg at 25°C
• Boiling Point: 691.4°C at 760 mmHg
• Flash Point: 269.8°C
• PSA: 78.90000
• Density: 0.93g/cm³
• LogP: 12.77510
• XLogP3: 16.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 40
• Exact Mass: 680.59549027
• Heavy Atom Count: 48
• Complexity: 643

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCC(=O)OCC(CC)(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCC

Technology Process of Trimethylolpropane trilaurate

There total 2 articles about Trimethylolpropane trilaurate 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:

lauric acid (143-07-7) + 1,1,1-tri(hydroxymethyl)propane (77-99-6) → trimethylolpropane lauric acid ester + 2-ethyl-2-{[(1-oxododecyl)oxy]methyl}propane-1,3-diyl dilaurate (25268-73-9) + C30H58O5 (68849-44-5)

Guidance literature:

With 1.05HO₃P*0.95C₆H₅O₃P^(2-)*0.1H₂O*Zr⁽²⁺⁾; at 180 ℃; for 1h;

DOI:10.1016/j.apcata.2013.04.043

Reference yield:

1,1,1-tri(hydroxymethyl)propane (77-99-6) + methyl n-dodecanoate (111-82-0) → 2-ethyl-2-{[(1-oxododecyl)oxy]methyl}propane-1,3-diyl dilaurate (25268-73-9)

Guidance literature:

With 3C₉H₁₄NO₃S⁽¹⁺⁾*O₄₀PW₁₂^(3-); at 120 ℃; for 2.5h;

DOI:10.1016/j.apcata.2010.11.011

upstream raw materials:

1,1,1-tri(hydroxymethyl)propane

methyl n-dodecanoate

lauric acid

Refernces

• 1、 Li, Kaixin,Chen, Li,Wang, Honglin,Lin, Weibin,Yan, Zongcheng. "Heteropolyacid salts as self-separation and recyclable catalysts for transesterification of trimethylolpropane". experimental part. p. 233 - 237. Retrieved 2011/11/06.