2-Ethylhexyl cyclohexanecarboxylate

Base Information

• Chemical Name: 2-Ethylhexyl cyclohexanecarboxylate
• CAS No.: 16397-74-3
• Molecular Formula: C15H28 O2
• Molecular Weight: 240.386
• European Community (EC) Number: 240-446-5
• DSSTox Substance ID: DTXSID20936892
• Nikkaji Number: J286.885G
• Mol file: 16397-74-3.mol

Synonyms:2-Ethylhexyl cyclohexanecarboxylate;16397-74-3;EINECS 240-446-5;2-ethylhexylcyclohexanoate;SCHEMBL2475295;DTXSID20936892;2-Ethylhexyl cyclohexanecarboxylate #;Cyclohexanecarboxylic acid 2-ethylhexyl ester;Cyclohexanecarboxylic acid, 2-ethylhexyl ester

Chemical Property of 2-Ethylhexyl cyclohexanecarboxylate

Chemical Property:

• Vapor Pressure: 0.00263mmHg at 25°C
• Boiling Point: 286.5°C at 760 mmHg
• Flash Point: 133°C
• PSA: 26.30000
• Density: 0.924g/cm³
• LogP: 4.32630
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 240.208930132
• Heavy Atom Count: 17
• Complexity: 207

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC)COC(=O)C1CCCCC1

Technology Process of 2-Ethylhexyl cyclohexanecarboxylate

There total 2 articles about 2-Ethylhexyl cyclohexanecarboxylate 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) + cyclohexanylcarbonyl chloride (2719-27-9) → 2-ethylhexyl cyclohexanecarboxylate (16397-74-3)

Guidance literature:

With 2,3-Dimethylaniline; In diethyl ether; at 35 ℃; overnight;

DOI:10.1021/j100366a029

Reference yield:

→ 2-ethylhexyl cyclohexanecarboxylate (16397-74-3)

Guidance literature:

/BRN= 2100735/;

upstream raw materials:

2-Ethylhexyl alcohol

cyclohexanylcarbonyl chloride

Refernces