1-Cyclohexylethyl ethyl carbonate

Base Information

• Chemical Name: 1-Cyclohexylethyl ethyl carbonate
• CAS No.: 93963-40-7
• Molecular Formula: C₁₁H₂₀O₃
• Molecular Weight: 200.278
• European Community (EC) Number: 300-783-1
• DSSTox Substance ID: DTXSID60916855
• Nikkaji Number: J349.568J
• Mol file: 93963-40-7.mol

Synonyms:1-Cyclohexylethyl ethyl carbonate;93963-40-7;EINECS 300-783-1;DTXSID60916855;Carbonic acid 1-cyclohexylethyl=ethyl

Chemical Property of 1-Cyclohexylethyl ethyl carbonate

Chemical Property:

• Vapor Pressure: 0.0185mmHg at 25°C
• Boiling Point: 253.2°C at 760 mmHg
• Flash Point: 94.8°C
• PSA: 35.53000
• Density: 0.994g/cm³
• LogP: 3.12830
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 200.14124450
• Heavy Atom Count: 14
• Complexity: 173

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)OC(C)C1CCCCC1

Technology Process of 1-Cyclohexylethyl ethyl carbonate

There total 2 articles about 1-Cyclohexylethyl ethyl carbonate 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: 98.0%

rac-1-cyclohexylethanol (1193-81-3) + Diethyl carbonate (105-58-8,76619-83-5) → ethyl 1-cyclohexylethyl carbonate (93963-40-7)

Guidance literature:

aluminum oxide; cesium fluoride; at 129.85 ℃; for 0.75h;

DOI:10.1002/ejoc.200400888

Reference yield: 96.0%

rac-1-cyclohexylethanol (1193-81-3) → ethyl 1-cyclohexylethyl carbonate (93963-40-7)

Guidance literature:

With γ-Fe2O3-immobilized 1,5,7-triazabicyclo[4.4.0]dec-5-ene nanoparticles (MNPs-TBD); at 125 ℃; for 6h;

DOI:10.1002/ejic.201301586

upstream raw materials:

rac-1-cyclohexylethanol

Diethyl carbonate

Refernces

• 1、 Wu, Liqiang,Tian, Shuanbao. "Immobilization of 1,5,7-triazabicyclo[4.4.0]dec-5-ene on magnetic γ-Fe2O3 nanoparticles: A highly recyclable and efficient nanocatalyst for the synthesis of organic carbonates". . p. 2080 - 2087. Retrieved 2014/05/06.