Propanoic acid, 3-cyclohexylidene-, ethyl ester

Base Information

• Chemical Name: Propanoic acid, 3-cyclohexylidene-, ethyl ester
• CAS No.: 18559-89-2
• Molecular Formula: C11H18O2
• Molecular Weight: 182.263
• DSSTox Substance ID: DTXSID50393838
• Nikkaji Number: J531.074A
• Mol file: 18559-89-2.mol

Synonyms:18559-89-2;Propanoic acid, 3-cyclohexylidene-, ethyl ester;DTXSID50393838;3-Cyclohexylidenepropanoic acid ethyl ester

Chemical Property of Propanoic acid, 3-cyclohexylidene-, ethyl ester

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 182.130679813
• Heavy Atom Count: 13
• Complexity: 186

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CC=C1CCCCC1

Technology Process of Propanoic acid, 3-cyclohexylidene-, ethyl ester

There total 17 articles about Propanoic acid, 3-cyclohexylidene-, ethyl 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: 92.0%

(E)-3-cyclohexyl-acrylic acid ethyl ester (17343-88-3) → 3-cyclohexylidene-propionic acid ethyl ester (18559-89-2)

Guidance literature:

With diethylamine; In dichloromethane; at 0 ℃; Irradiation;

DOI:10.1016/S0040-4020(01)85681-7

Reference yield: 90.0%

1-((Z)-3-Cyclohexylidene-1-ethoxy-propenyl)-1H-benzotriazole (190603-16-8) → 3-cyclohexylidene-propionic acid ethyl ester (18559-89-2)

Guidance literature:

With toluene-4-sulfonic acid; In ethanol; for 40h; Heating;

DOI:10.1021/jo9701647

Reference yield: 86.0%

1-(2,2-diethoxycyclopropyl)cyclohexanol → 3-cyclohexylidene-propionic acid ethyl ester (18559-89-2)

Guidance literature:

With trifluoroacetic acid; In chloroform; Ambient temperature;

DOI:10.1021/ja9808954

upstream raw materials:

β-cyclohexylidenepropionic acid

(E)-3-cyclohexyl-acrylic acid ethyl ester

cyclohexane

propynoic acid ethyl ester