2-(2-Chlorophenoxy)propanoic acid 3,3,5-trimethylcyclohexyl ester

Base Information

• Chemical Name: 2-(2-Chlorophenoxy)propanoic acid 3,3,5-trimethylcyclohexyl ester
• CAS No.: 58327-12-1
• Molecular Formula: C18H25ClO3
• Molecular Weight: 324.8423
• DSSTox Substance ID: DTXSID80973884

Synonyms:BRN 2290805;2-(2-Chlorophenoxy)propanoic acid 3,3,5-trimethylcyclohexyl ester;Propanoic acid, 2-(2-chlorophenoxy)-, 3,3,5-trimethylcyclohexyl ester;58327-12-1;DTXSID80973884;LS-121297;3,3,5-Trimethylcyclohexyl 2-(2-chlorophenoxy)propanoate

Chemical Property of 2-(2-Chlorophenoxy)propanoic acid 3,3,5-trimethylcyclohexyl ester

Chemical Property:

• Vapor Pressure: 2.53E-06mmHg at 25°C
• Boiling Point: 391.1°Cat760mmHg
• Flash Point: 131.8°C
• Density: 1.11g/cm³
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 324.1492223
• Heavy Atom Count: 22
• Complexity: 383

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC(CC(C1)(C)C)OC(=O)C(C)OC2=CC=CC=C2Cl

Technology Process of 2-(2-Chlorophenoxy)propanoic acid 3,3,5-trimethylcyclohexyl ester

There total 1 articles about 2-(2-Chlorophenoxy)propanoic acid 3,3,5-trimethylcyclohexyl 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:

3,3,5-trimethylcyclohexanol (116-02-9) + 2-(2-chlorophenoxy)propionic acid (76466-16-5) → 2-(2-Chloro-phenoxy)-propionic acid 3,3,5-trimethyl-cyclohexyl ester (58327-12-1)

Guidance literature:

upstream raw materials:

3,3,5-trimethylcyclohexanol

2-(2-chlorophenoxy)propionic acid

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