Octadecanoic acid, 12-hydroxy-, 2-ethylhexyl ester

Base Information

• Chemical Name: Octadecanoic acid, 12-hydroxy-, 2-ethylhexyl ester
• CAS No.: 29710-25-6
• Molecular Formula: C26H52O3
• Molecular Weight: 412.697
• Hs Code.: 2918199090
• European Community (EC) Number: 249-793-7
• UNII: B7I80BVV5E
• DSSTox Substance ID: DTXSID70865507
• Nikkaji Number: J286.938A
• Wikidata: Q27274466
• RXCUI: 1368707
• Mol file: 29710-25-6.mol

Synonyms:2-Ethylhexyl 12-hydroxyoctadecanoate;29710-25-6;2-Ethylhexyl 12-hydroxystearate;Octadecanoic acid, 12-hydroxy-, 2-ethylhexyl ester;Octyl hydroxystearate;2-Ethylhexyl hydroxystearate;B7I80BVV5E;29383-26-4;EINECS 249-793-7;2-Ethylhexyl 12-hydroxy octadecanoate;12-Hydroxyoctadecanoic acid, 2-ethylhexyl ester;Octadecanoic acid,12-hydroxy-, 2-ethylhexyl ester;RISOCAST IOHS;CRODAMOL OHS;PELEMOL OHS;DUB HSO;2-Ethylhexyl oxystearate;UNII-B7I80BVV5E;SCHERCEMOL OHS ESTER;SCHEMBL4173514;DTXSID70865507;GLCFQKXOQDQJFZ-UHFFFAOYSA-N;OCTYL HYDROXYSTEARATE [VANDF];ETHYLHEXYL HYDROXYSTEARATE [II];ETHYLHEXYL HYDROXYSTEARATE [INCI];12-Hydroxyoctadecanoic acid 2-ethylhexyl ester;Octadecanoic acid, hydroxy-, 2-ethylhexyl ester;Octadecanoic acid,12-hydroxy-,2-ethylhexyl ester;W-110762;Q27274466

Chemical Property of Octadecanoic acid, 12-hydroxy-, 2-ethylhexyl ester

Chemical Property:

• Appearance/Colour: Clear, Light Amber Liquid.
• Vapor Pressure: 1.1E-11mmHg at 25°C
• Refractive Index: 1.459
• Boiling Point: 490.6 °C at 760 mmHg
• Flash Point: 175.6 °C
• PSA: 46.53000
• Density: 0.898 g/cm^3/sup>
• LogP: 7.97830
• XLogP3: 9.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 23
• Exact Mass: 412.39164552
• Heavy Atom Count: 29
• Complexity: 343

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)O

Technology Process of Octadecanoic acid, 12-hydroxy-, 2-ethylhexyl ester

There total 3 articles about Octadecanoic acid, 12-hydroxy-, 2-ethylhexyl 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:

→ 2-ethylhexyl 12-hydroxystearate (29710-25-6)

Guidance literature:

With nickel; at 140 ℃; under 7355.08 Torr; Hydrogenation;

Reference yield:

2-Ethylhexyl alcohol (104-76-7) + 12-Hydroxystearic acid (106-14-9,78642-86-1,8039-23-4,27924-99-8,860114-96-1) → 2-ethylhexyl 12-hydroxystearate (29710-25-6)

Guidance literature:

With hydrogenchloride; at 85 - 90 ℃; Entfernung des Reaktionswassers durch Vakuumdestillation;

Reference yield:

→ 2-ethylhexyl 12-hydroxystearate (29710-25-6)

Guidance literature:

upstream raw materials:

2-Ethylhexyl alcohol

12-Hydroxystearic acid

Refernces