Octadecyl octadec-9-enoate

Base Information

• Chemical Name: Octadecyl octadec-9-enoate
• CAS No.: 17673-49-3
• Molecular Formula: C36H70 O2
• Molecular Weight: 534.951
• Hs Code.: 2916150000
• European Community (EC) Number: 241-651-2
• DSSTox Substance ID: DTXSID5066243
• Mol file: 17673-49-3.mol

Synonyms:17673-49-3;octadecyl octadec-9-enoate;DTXSID5066243;FT-0637582

Chemical Property of Octadecyl octadec-9-enoate

Chemical Property:

• Vapor Pressure: 7.4E-14mmHg at 25°C
• Melting Point: 28.5 °C
• Boiling Point: 589.1°Cat760mmHg
• Flash Point: 50.1°C
• PSA: 26.30000
• Density: 0.862g/cm³
• LogP: 12.82860
• Storage Temp.: −20°C
• XLogP3: 16.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 33
• Exact Mass: 534.53758147
• Heavy Atom Count: 38
• Complexity: 470

Purity/Quality:

99% ^*data from raw suppliers

OLEIC ACID STEARYL ESTER 99.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCC=CCCCCCCCC

Technology Process of Octadecyl octadec-9-enoate

There total 6 articles about Octadecyl octadec-9-enoate 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: 21.0%

1-octadecanol (112-92-5) + cis-Octadecenoic acid (112-80-1,2027-47-6) → (Z)-octadecyl ester 9-octadecenoic acid (17673-49-3)

Guidance literature:

at 30 ℃; for 72h; Corynebacterium sp. S-401, phosphate buffer;

Reference yield:

oleoyl alcohol (143-28-2,593-47-5,84286-21-5) + cis-Octadecenoic acid (112-80-1,2027-47-6) → (Z)-octadecyl ester 9-octadecenoic acid (17673-49-3)

Guidance literature:

With Thermomyces lanuginosus lipase; at 37 ℃; for 24h; Enzymatic reaction;

DOI:10.1002/cctc.202101050

Reference yield:

→ (Z)-octadecyl ester 9-octadecenoic acid (17673-49-3)

Guidance literature:

With nickel kieselguhr; Hydrogenation;

upstream raw materials:

1-octadecanol

cis-Octadecenoic acid

oleic acid oleylester

oleoyl alcohol

Refernces

• 1、 -. "PRODUCTION METHOD OF ESTER COMPOUND". Paragraph 0030; 0033. . Retrieved 2019/10/01.
• 2、 Vieville, Corinne,Mouloungui, Zephirin,Gaset, Antoine. "Synthesis and analysis of the C1-C18 alkyl oleates". . p. 101 - 108. Retrieved 2007/10/02.