Octadecanoic acid, 2-ethyl-2-(hydroxymethyl)-1,3-propanediyl ester

Base Information

• Chemical Name: Octadecanoic acid, 2-ethyl-2-(hydroxymethyl)-1,3-propanediyl ester
• CAS No.: 66753-01-3
• Deprecated CAS: 107577-59-3
• Molecular Formula: C42H82O5
• Molecular Weight: 667.0975
• European Community (EC) Number: 266-471-1
• DSSTox Substance ID: DTXSID7070474
• Nikkaji Number: J310.147I
• Wikidata: Q81997789
• Mol file: 66753-01-3.mol

Synonyms:66753-01-3;EINECS 266-471-1;Octadecanoic acid, 2-ethyl-2-(hydroxymethyl)-1,3-propanediyl ester;Octadecanoic acid, 1,1'-(2-ethyl-2-(hydroxymethyl)-1,3-propanediyl) ester;trimethylolpropane distearate;SCHEMBL2703955;DTXSID7070474;2-Ethyl-2-(hydroxymethyl)propane-1,3-diyl distearate;Bisoctadecanoic acid 2-ethyl-2-(hydroxymethyl)-1,3-propanediyl ester;STEARIC ACID 2-ETHYL-2-(HYDROXYMETHYL)-1,3-PROPANEDIYL ESTER

Chemical Property of Octadecanoic acid, 2-ethyl-2-(hydroxymethyl)-1,3-propanediyl ester

Chemical Property:

• Vapor Pressure: 2.9E-21mmHg at 25°C
• Boiling Point: 677.5°Cat760mmHg
• Flash Point: 181.2°C
• PSA: 72.83000
• Density: 0.918g/cm³
• LogP: 12.98450
• XLogP3: 17.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 40
• Exact Mass: 666.61622571
• Heavy Atom Count: 47
• Complexity: 613

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC(CC)(CO)COC(=O)CCCCCCCCCCCCCCCCC