2-Glyceryl capryl ether

Base Information

• Chemical Name: 2-Glyceryl capryl ether
• CAS No.: 17174-65-1
• Molecular Formula: C₁₃H₂₈O₃
• Molecular Weight: 232.364
• UNII: DJ0STZ3V2G
• DSSTox Substance ID: DTXSID90169155
• Nikkaji Number: J116.274H
• Wikidata: Q27276418
• Mol file: 17174-65-1.mol

Synonyms:2-Glyceryl capryl ether;2-(Decyloxy)-1,3-propanediol;UNII-DJ0STZ3V2G;DJ0STZ3V2G;1,3-Propanediol, 2-(decyloxy)-;17174-65-1;SCHEMBL100166;DTXSID90169155;PNEISLXOVRTHDC-UHFFFAOYSA-N;Q27276418

Chemical Property of 2-Glyceryl capryl ether

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 12
• Exact Mass: 232.20384475
• Heavy Atom Count: 16
• Complexity: 124

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCOC(CO)CO

Technology Process of 2-Glyceryl capryl ether

There total 4 articles about 2-Glyceryl capryl ether 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: 49.0%

3-decanoyloxy-propane-1,2-diol (2277-23-8) + glycerol (56-81-5,25618-55-7,64333-26-2,8013-25-0) → glycerol 1-O-decylether (10430-97-4) + 2-decyloxy-propane-1,3-diol (17174-65-1)

Guidance literature:

With 5%-palladium/activated carbon; hydrogen; at 120 ℃; for 16h; under 37503.8 Torr; regioselective reaction; Autoclave;

DOI:10.1039/c3gc36907b

Reference yield: 43.0%

Methyl decanoate (110-42-9) + glycerol (56-81-5,25618-55-7,64333-26-2,8013-25-0) → glycerol 1-O-decylether (10430-97-4) + 2-decyloxy-propane-1,3-diol (17174-65-1)

Guidance literature:

With 5%-palladium/activated carbon; camphor-10-sulfonic acid; hydrogen; at 120 ℃; for 16h; under 37503.8 Torr; regioselective reaction; Autoclave;

DOI:10.1039/c3gc36907b

Reference yield:

caprinaldehyde (112-31-2) + glycerol (56-81-5,25618-55-7,64333-26-2,8013-25-0) → glycerol 1-O-decylether (10430-97-4) + rac-1,2-didecyl glycerol (97041-17-3) + 2-decyloxy-propane-1,3-diol (17174-65-1) + didecylglycerol (95491-64-8)

Guidance literature:

With hydrogen; palladium 10% on activated carbon; at 200 ℃; for 22h; under 51716.2 Torr;

upstream raw materials:

caprinaldehyde

glycerol

3-decanoyloxy-propane-1,2-diol

Methyl decanoate

Refernces

• 1、 -. "Coalescent for aqueous compositions". Page/Page column 6. . Retrieved 2012/03/26.