Cyclohexyl stearate

Base Information

• Chemical Name: Cyclohexyl stearate
• CAS No.: 104-07-4
• Molecular Formula: C24H46 O2
• Molecular Weight: 366.628
• Hs Code.: 2915709000
• European Community (EC) Number: 203-171-1
• DSSTox Substance ID: DTXSID30146203
• Nikkaji Number: J182.175J
• Wikidata: Q83010967
• Mol file: 104-07-4.mol

Synonyms:Cyclohexyl stearate;cyclohexyl octadecanoate;104-07-4;EINECS 203-171-1;cyclohexylstearat-;Stearic acid cyclohexyl ester;SCHEMBL181505;DTXSID30146203;Octadecanoic acid, cyclohexyl ester

Chemical Property of Cyclohexyl stearate

Chemical Property:

• Vapor Pressure: 3.33E-07mmHg at 25°C
• Melting Point: 44°C
• Refractive Index: 1.4894 (estimate)
• Boiling Point: 418.3°Cat760mmHg
• Flash Point: 186°C
• PSA: 26.30000
• Density: 0.9g/cm³
• LogP: 8.12380
• XLogP3: 10.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 18
• Exact Mass: 366.349780706
• Heavy Atom Count: 26
• Complexity: 307

Purity/Quality:

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCC(=O)OC1CCCCC1

Technology Process of Cyclohexyl stearate

There total 2 articles about Cyclohexyl stearate 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: 95.0%

stearic acid (57-11-4) + cyclohexanol (108-93-0) → cyclohexyl octadecanoate (104-07-4)

Guidance literature:

With toluene-4-sulfonic acid; for 0.05h; Irradiation;

Reference yield: 93.0%

Octadecanoic acid (Z)-2-dimethylcarbamoyl-1-methyl-vinyl ester (89611-18-7) + cyclohexanol (108-93-0) → cyclohexyl octadecanoate (104-07-4)

Guidance literature:

With (1S)-10-camphorsulfonic acid; In dichloromethane; at 40 ℃; other solvent and temperature;

DOI:10.1016/S0040-4039(00)99860-5

upstream raw materials:

stearic acid

cyclohexanol

Octadecanoic acid (Z)-2-dimethylcarbamoyl-1-methyl-vinyl ester

Refernces

• 1、 Ramalinga,Vijayalakshmi,Kaimal. "A mild and efficient method for esterification and transesterification catalyzed by iodine". . p. 879 - 882. Retrieved 2007/10/03.
• 2、 Gais, H.-J.. "LACTONISIERUNG VON MAKROLID-SECOSAEUREN MIT "PUSH-PULL ACETYLENEN"". . p. 273 - 276. Retrieved 2007/10/02.