Octyl 9,10-epoxystearate

Base Information

• Chemical Name: Octyl 9,10-epoxystearate
• CAS No.: 106-84-3
• Deprecated CAS: 31833-76-8,52622-84-1,1902912-75-7
• Molecular Formula: C26H50 O3
• Molecular Weight: 410.681
• Hs Code.: 2918990090
• European Community (EC) Number: 203-435-6
• DSSTox Substance ID: DTXSID50861724
• Nikkaji Number: J182.217I
• Mol file: 106-84-3.mol

Synonyms:Octyl 9,10-epoxystearate;106-84-3;Octyl 3-Octyloxiraneoctanoic Acid;octyl 8-(3-octyloxiran-2-yl)octanoate;Lankroflex ED 3;Octyl epoxystearate;Sansocizer E 6000;Octyl oleate epoxide;Drapex 3.2;Octyl,3-octyloxiraneoctanoic acid;ADK Cizer D 32;Oxiraneoctanoic acid, 3-octyl-, octyl ester;HSDB 5375;Octyl 3-octyloxiran-2-octanoate;2-Oxiraneoctanoic acid, 3-octyl-, octyl ester;EINECS 203-435-6;2-Oxiraneoctanoic acid,3-octyl-, octyl ester;Octadecanoic acid, 9,10-epoxy-, octyl ester;octyl-3-octyloxiran-2-octanoat;SCHEMBL5730879;DTXSID50861724;9,10-Epoxyoctadecanoic acid octyl ester;FT-0673239;J-001660

Chemical Property of Octyl 9,10-epoxystearate

Chemical Property:

• Vapor Pressure: 1.9E-09mmHg at 25°C
• Melting Point: -14 °C
• Refractive Index: 1.459
• Boiling Point: 482°Cat760mmHg
• Flash Point: 180.8°C
• PSA: 38.83000
• Density: 0.906g/cm³
• LogP: 8.13880
• Storage Temp.: Refrigerator
• Solubility.: Chloroform (Slightly), Ethyl Acetate (Slightly)
• XLogP3: 9.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 23
• Exact Mass: 410.37599545
• Heavy Atom Count: 29
• Complexity: 369

Purity/Quality:

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

Octyl3-OctyloxiraneoctanoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Plastics & Rubber -> Other Plasticizers
• Canonical SMILES: CCCCCCCCC1C(O1)CCCCCCCC(=O)OCCCCCCCC
• Uses: Octyl 3-Octyloxiraneoctanoic Acid (cas# 106-84-3) is a compound useful in organic synthesis.

Technology Process of Octyl 9,10-epoxystearate

There total 3 articles about Octyl 9,10-epoxystearate 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: 95.8%

octyl oleate (906508-80-3) → octyl 3-octyloxiran-2-octanoate (106-84-3,52622-84-1)

Guidance literature:

With tert.-butylhydroperoxide; In decane; at 20 ℃; for 7h;

DOI:10.1039/c5nj00744e

Reference yield:

cis-9-octadecenoic acid octyl ester (32953-65-4) → octyl 3-octyloxiran-2-octanoate (106-84-3,52622-84-1)

Guidance literature:

With formic acid; dihydrogen peroxide; at 15 ℃; for 15h;

DOI:10.1007/s11746-007-1083-z

Reference yield:

→ octyl 3-octyloxiran-2-octanoate (106-84-3,52622-84-1)

Guidance literature:

entspr. Na-Alkoholat, Triepoxyolein;

upstream raw materials:

cis-9-octadecenoic acid octyl ester

octyl oleate

Refernces

• 1、 Moser, Bryan R.,Sharma, Brajendra K.,Doll, Kenneth M.,Erhan, Sevim Z.. "Diesters from oleic acid: Synthesis, low temperature properties, and oxidation stability". . p. 675 - 680. Retrieved 2008/09/21.