Ethyl 2-(2,6-dimethylphenoxy)propanoate

Base Information

• Chemical Name: Ethyl 2-(2,6-dimethylphenoxy)propanoate
• CAS No.: 124317-26-6
• Molecular Formula: C13H18O3
• Molecular Weight: 222.284
• DSSTox Substance ID: DTXSID30573691
• Mol file: 124317-26-6.mol

Synonyms:124317-26-6;Ethyl 2-(2,6-dimethylphenoxy)propanoate;DTXSID30573691

Chemical Property of Ethyl 2-(2,6-dimethylphenoxy)propanoate

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 222.125594432
• Heavy Atom Count: 16
• Complexity: 217

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C(C)OC1=C(C=CC=C1C)C

Technology Process of Ethyl 2-(2,6-dimethylphenoxy)propanoate

There total 3 articles about Ethyl 2-(2,6-dimethylphenoxy)propanoate 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: 85.0%

2.6-dimethylphenol (576-26-1,25134-01-4) + Ethyl 2-bromopropionate (535-11-5,41978-69-2) → (RS)-ethyl 2-(2,6-dimethylphenoxy)propanoate (124317-26-6)

Guidance literature:

2.6-dimethylphenol; With sodium ethanolate; In ethanol; for 0.5h;

Ethyl 2-bromopropionate; In ethanol; at 70 ℃; for 5h;

DOI:10.1016/j.ejmech.2016.07.066

Reference yield:

potassium 2,6-dimethylphenolate (58425-33-5) + Ethyl 2-bromopropionate (535-11-5,41978-69-2) → (RS)-ethyl 2-(2,6-dimethylphenoxy)propanoate (124317-26-6)

Guidance literature:

Reference yield:

→ (RS)-ethyl 2-(2,6-dimethylphenoxy)propanoate (124317-26-6)

Guidance literature:

CH3-CHBr-CO2Et, entspr. Phenol ;

upstream raw materials:

potassium 2,6-dimethylphenolate

Ethyl 2-bromopropionate

2.6-dimethylphenol

Downstream raw materials:

[4-(2-Dimethylamino-1-methyl-ethoxy)-3,5-dimethyl-phenyl]-phenyl-methanone

2-(2-Chloro-1-methyl-ethoxy)-1,3-dimethyl-benzene

2-(3,4-Diamino-2,6-dimethyl-phenoxy)-propionic acid ethyl ester

2-<1-(2,6-dimethylphenoxy)ethyl>-4,5-dihydrothiazole