Tritridecanoin

Base Information

• Chemical Name: Tritridecanoin
• CAS No.: 26536-12-9
• Molecular Formula: C42H80 O6
• Molecular Weight: 681.094
• Hs Code.: 2915900090
• UNII: YN56Q9YH9J
• DSSTox Substance ID: DTXSID60181107
• Nikkaji Number: J118.337K
• Wikidata: Q2211939
• Metabolomics Workbench ID: 8974
• Mol file: 26536-12-9.mol

Synonyms:Tritridecanoin;Glyceryl tritridecanoate;26536-12-9;1,2,3-Tritridecanoylglycerol;2,3-di(tridecanoyloxy)propyl tridecanoate;UNII-YN56Q9YH9J;YN56Q9YH9J;1,2,3-tritridecanoyl-sn-glycerol;EINECS 247-765-9;TG(13:0/13:0/13:0);propane-1,2,3-triyl tritridecanoate;Tritridecanoin, 8CI;Glycerol tritridecanoate;TRIDECANOIN, TRI-;GLYCERIN TRITRIDECANOATE;SCHEMBL2445780;DTXSID60181107;CHEBI:177670;Glyceryl tritridecanoate, >=99%;GLYCEROL TRIS(TRIDECANOATE);LMGL03012619;MFCD00198038;1-O,2-O,3-O-Tritridecanoylglycerol;1,2,3-Propanetriyl tritridecanoate, 9CI;AS-82721;BP-29842;1,3-bis(tridecanoyloxy)propan-2-yl tridecanoate;J-016465;Q2211939;TRIDECANOIC ACID, 1,2,3-PROPANETRIYL ESTER;TRIDECANOIC ACID, 1,1',1''-(1,2,3-PROPANETRIYL) ESTER;1,2,3-Tritridecanoylglycerol, TG(13:0/13:0/13:0), Tritridecanoin (C13:0)

Chemical Property of Tritridecanoin

Chemical Property:

• Vapor Pressure: 5.07E-18mmHg at 25°C
• Boiling Point: 578.6°Cat760mmHg
• Flash Point: 233.3°C
• PSA: 78.90000
• Density: 0.949g/cm³
• LogP: 12.91760
• Storage Temp.: −20°C
• Solubility.: Chloroform (Slightly), DMSO (Slightly, Heated)
• XLogP3: 17.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 41
• Exact Mass: 680.59549027
• Heavy Atom Count: 48
• Complexity: 668

Purity/Quality:

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

Glyceryl tritridecanoate ^*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: CCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCC)OC(=O)CCCCCCCCCCCC
• Description: 1,2,3-Tritridecanoyl glycerol is a synthetic triacylglycerol that contains tridecanoic acid in the sn-1, sn-2, and sn-3 positions. It has been used as a standard for the relative quantification of triacylglycerols in C. elegans fat stores. It has also been used as an internal standard for the quantification of triacylglycerols in the serum and liver of adult rat offspring receiving dietary conjugated linoleic acids during and after gestation.
• Uses: Glyceryl Tritridecanoate is used in cosmetics that stimulates the growth of hair and skin.

Technology Process of Tritridecanoin

There total 1 articles about Tritridecanoin 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:

tridecanoic acid (638-53-9) + glycerol (56-81-5,25618-55-7,64333-26-2,8013-25-0) → tri(tridecanoyl)-sn-glycerol (26536-12-9)

Guidance literature:

With zinc; unter vermindertem Druck;

upstream raw materials:

tridecanoic acid

glycerol

Refernces