2-Ethylhexyl 12-(acetoxy)octadecanoate

Base Information

• Chemical Name: 2-Ethylhexyl 12-(acetoxy)octadecanoate
• CAS No.: 61800-40-6
• Molecular Formula: C28H54 O4
• Molecular Weight: 454.734
• European Community (EC) Number: 263-233-9
• UNII: OI71298RE2
• DSSTox Substance ID: DTXSID40977383
• Nikkaji Number: J306.901J
• Wikidata: Q27285666
• Mol file: 61800-40-6.mol

Synonyms:ethylhexyl acetoxystearate;61800-40-6;2-Ethylhexyl 12-(acetoxy)octadecanoate;UNII-OI71298RE2;OI71298RE2;EINECS 263-233-9;2-ethylhexyl 12-acetoxystearate;SCHEMBL5172266;DTXSID40977383;DDGZCTKMHAYRKN-UHFFFAOYSA-N;AEC ETHYLHEXYL ACETOXYSTEARATE;ETHYLHEXYL ACETOXYSTEARATE [INCI];(+/-)-ETHYLHEXYL ACETOXYSTEARATE;2- ethylhexyl 12- (acetoxy)octadecanoate;ETHYLHEXYL ACETOXYSTEARATE, (+/-)-;12-(Acetyloxy)stearic acid 2-ethylhexyl ester;2-ETHYLHEXYL 12-(ACETYLOXY)OCTADECANOATE;2-ETHYLHEXYL 12-ACETOXYOCTADECANOIC ACID;Q27285666;12-ACETOXYOCTADECANOIC ACID, 2-ETHYLHEXYL ESTER;Octadecanoic acid, 12-(acetyloxy)-, 2-ethylhexyl ester;OCTADECANOIC ACID, 12-HYDROXY-, 2-ETHYLHEXYL ESTER, ACETATE

Chemical Property of 2-Ethylhexyl 12-(acetoxy)octadecanoate

Chemical Property:

• Vapor Pressure: 2.86E-08mmHg at 25°C
• Boiling Point: 449.4°C at 760 mmHg
• Flash Point: 199.5°C
• PSA: 52.60000
• Density: 0.912g/cm³
• LogP: 8.54910
• XLogP3: 10.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 25
• Exact Mass: 454.40221020
• Heavy Atom Count: 32
• Complexity: 435

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(CCCCCCCCCCC(=O)OCC(CC)CCCC)OC(=O)C

Technology Process of 2-Ethylhexyl 12-(acetoxy)octadecanoate

There total 1 articles about 2-Ethylhexyl 12-(acetoxy)octadecanoate 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:

2-Ethylhexyl alcohol (104-76-7) + R-12-hydroxyoctadecanoic acid (106-14-9,18417-00-0,36377-33-0,5762-36-7,78642-86-1,8039-23-4,27924-99-8,860114-96-1) → (R)-12-acetoxy-octadecanoic acid-((Ξ)-2-ethyl-hexyl ester) (61800-40-6)

Guidance literature:

With sulfuric acid; benzene; Entfernen des entstehenden Wassers und Erwaermen des Reaktionsprodukts mit Acetanhydrid und wenig Acetylchlorid;

DOI:10.1021/ie50524a045

upstream raw materials:

2-Ethylhexyl alcohol

R-12-hydroxyoctadecanoic acid