Trielaidin

Base Information

• Chemical Name: Trielaidin
• CAS No.: 537-39-3
• Molecular Formula: C57H104 O6
• Molecular Weight: 885.449
• Hs Code.: 2916190090
• European Community (EC) Number: 208-665-0
• UNII: 352S6U20HL
• DSSTox Substance ID: DTXSID101318457
• Nikkaji Number: J188.384D
• Wikidata: Q27124197
• Mol file: 537-39-3.mol

Synonyms:Glycerol Trioleate;Glycerol, Trioleyl;Trielaidin;Trioleate Glycerin;Trioleate, Glycerol;Trioleate-Glycerin;Triolein;Trioleoylglycerol;Trioleyl Glycerol

Chemical Property of Trielaidin

Chemical Property:

• Melting Point: 42°C
• Refractive Index: 1.4381 (estimate)
• Boiling Point: 818.7°Cat760mmHg
• Flash Point: 302.6°C
• PSA: 78.90000
• Density: 0.921g/cm³
• LogP: 18.09710
• Storage Temp.: −20°C
• Solubility.: almost transparency in Toluene
• XLogP3: 22.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 53
• Exact Mass: 884.78329103
• Heavy Atom Count: 63
• Complexity: 1010

Purity/Quality:

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

Trielaidin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)OC(=O)CCCCCCCC=CCCCCCCCC
• Isomeric SMILES: CCCCCCCC/C=C/CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C/CCCCCCCC)COC(=O)CCCCCCC/C=C/CCCCCCCC
• Uses: Trielaidin is a component of partially hydrogenated vegetable oils.

Technology Process of Trielaidin

There total 13 articles about Trielaidin 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: 85.0%

Elaidic acid (112-79-8,2027-47-6) + glycerol (56-81-5,25618-55-7,64333-26-2,8013-25-0) → trielaidin (537-39-3)

Guidance literature:

With toluene-4-sulfonic acid; at 115 ℃; for 5h;

DOI:10.1007/s11746-007-1056-2

Reference yield:

trioleoylglycerol (122-32-7) → trielaidin (537-39-3) + C96H172O12 + C135H240O18 + C99H168O18

Guidance literature:

With ZnCl₂-modified mesoporous alumina supported methyltrioxorhenium; In hexane; at 45 ℃; for 1h;

DOI:10.1016/j.apcata.2014.04.016

Reference yield:

1,2,3-tribromopropane (96-11-7) → trielaidin (537-39-3)

Guidance literature:

With xylene; at 170 - 190 ℃;

upstream raw materials:

trioleoylglycerol

Elaidic acid

1-mono[trans-9-octadecenoyl]-rac-glycerol

(Z)-9-octadecenoyl chloride

Downstream raw materials:

(E)-9-octadecenoic acid amide

Elaidic acid

1-mono[trans-9-octadecenoyl]-rac-glycerol

2-hydroxy-3-[(9E)-9-octadecenoyloxy]propyl (9E)-9-octadecenoate

Refernces

• 1、 Christy, Alfred A.,Xu, Zhanfeng,Harrington, Peter de B.. "Thermal degradation and isomerisation kinetics of triolein studied by infrared spectrometry and GC-MS combined with chemometrics". experimental part. p. 22 - 31. Retrieved 2010/02/28.
• 2、 Lie Ken Jie, Marcel S.F.,Lam. "1H-Nuclear magnetic resonance spectroscopic studies of saturated, acetylenic and ethylenic triacylglycerols". . p. 155 - 171. Retrieved 2007/10/03.