(E)-9-Octadecenoic acid butyl ester

Base Information

• Chemical Name: (E)-9-Octadecenoic acid butyl ester
• CAS No.: 22147-33-7
• Molecular Formula: C₂₂H₄₂O₂
• Molecular Weight: 338.574
• Nikkaji Number: J46.874F
• Wikidata: Q63395588
• Mol file: 22147-33-7.mol

Synonyms:22147-33-7;(E)-9-Octadecenoic acid butyl ester;butyl elaidate;(Oleic acid, butyl ester);Octadecenoic acid, butyl ester;9-Octadecenoic acid, butyl ester, (E)-;9-Octadecenoic acid, butyl ester, (Z)-;SCHEMBL79293;SCHEMBL3656012;9-Octadecenoic acid butyl ester;AKOS015901705;Q63395588

Chemical Property of (E)-9-Octadecenoic acid butyl ester

Chemical Property:

• Vapor Pressure: 4.29E-07mmHg at 25°C
• Boiling Point: 414.9°Cat760mmHg
• Flash Point: 89.7°C
• PSA: 26.30000
• Density: 0.87g/cm³
• LogP: 7.36720
• XLogP3: 8.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 19
• Exact Mass: 338.318480578
• Heavy Atom Count: 24
• Complexity: 284

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCCCC
• Isomeric SMILES: CCCCCCCC/C=C/CCCCCCCC(=O)OCCCC

Technology Process of (E)-9-Octadecenoic acid butyl ester

There total 3 articles about (E)-9-Octadecenoic acid butyl ester 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:

Elaidic acid (112-79-8,2027-47-6) + butan-1-ol (71-36-3) → trans-Octadecen-9-saeure-n-butylester (22147-33-7)

Guidance literature:

With pancreas-drysubstances;

Reference yield:

1-bromo-butane (109-65-9) → trans-Octadecen-9-saeure-n-butylester (22147-33-7)

Guidance literature:

Reference yield:

→ trans-Octadecen-9-saeure-n-butylester (22147-33-7)

Guidance literature:

Octadec-9t-ensaeure, Butanol, H2SO4, Δ;

upstream raw materials:

Elaidic acid

butan-1-ol

1-bromo-butane