Ethyl 2-(4-hydroxy-2-methylphenoxy)-2-methylpropanoate

Base Information

• Chemical Name: Ethyl 2-(4-hydroxy-2-methylphenoxy)-2-methylpropanoate
• CAS No.: 328919-32-0
• Molecular Formula: C13H18O4
• Molecular Weight: 238.284
• DSSTox Substance ID: DTXSID20587863
• Wikidata: Q82480346
• Mol file: 328919-32-0.mol

Synonyms:ETHYL 2-(4-HYDROXY-2-METHYLPHENOXY)-2-METHYLPROPANOATE;328919-32-0;Ethyl2-(4-hydroxy-2-methylphenoxy)-2-methylpropanoate;SCHEMBL1549824;DTXSID20587863;ZLLUDQCJBVEZTQ-UHFFFAOYSA-N;DA-34474;CS-0112798;A821496;ethyl 2-[(4-hydroxy-2-methylphenyl)oxy]-2-methylpropanoate;2-(4-Hydroxy-2-methyl-phenoxy)-2-methyl-propionic Acid Ethyl Ester;2-(4-hydroxy-2-methylphenoxy)-2-methylpropionic acid ethyl ester;Propanoic acid, 2-(4-hydroxy-2-methylphenoxy)-2-methyl-, ethyl ester

Chemical Property of Ethyl 2-(4-hydroxy-2-methylphenoxy)-2-methylpropanoate

Chemical Property:

• PSA: 55.76000
• LogP: 2.42110
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 238.12050905
• Heavy Atom Count: 17
• Complexity: 262

Purity/Quality:

97% ^*data from raw suppliers

Ethyl2-(4-hydroxy-2-methylphenoxy)-2-methylpropanoate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C(C)(C)OC1=C(C=C(C=C1)O)C

Technology Process of Ethyl 2-(4-hydroxy-2-methylphenoxy)-2-methylpropanoate

There total 11 articles about Ethyl 2-(4-hydroxy-2-methylphenoxy)-2-methylpropanoate 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: 78.0%

C22H38O4Si → 2-(4-Hydroxy-2-methyl-phenoxy)-2-methyl-propionic Acid Ethyl Ester (328919-32-0)

Guidance literature:

With ammonium fluoride; In methanol; at 22 ℃; for 24h;

DOI:10.1021/op700141u

Reference yield: 76.0%

C20H24O5 (860262-38-0) → 2-(4-Hydroxy-2-methyl-phenoxy)-2-methyl-propionic Acid Ethyl Ester (328919-32-0)

Guidance literature:

With hydrogen; palladium on activated carbon; In ethanol; at 20 ℃; for 6h;

Reference yield:

2-(4-benzyloxy-2-formylphenoxy)-2-methyl propionic acid ethyl ester (328919-31-9) → 2-(4-Hydroxy-2-methyl-phenoxy)-2-methyl-propionic Acid Ethyl Ester (328919-32-0)

Guidance literature:

With hydrogen; 5%-palladium/activated carbon; In ethanol; at 20 - 40 ℃; for 6h; under 3102.97 Torr;

upstream raw materials:

2-(4-acetyl-2-methylphenoxy)-2-methylpropionic acid ethyl ester

ethyl 2-bromoisobutyrate

4-hydroxy-3-methylphenyl methyl ketone

2-(4-benzyloxy-2-formylphenoxy)-2-methyl propionic acid ethyl ester

Downstream raw materials:

2-methyl-2-{2-methyl-4-[3-(4-trifluoromethoxyphenyl)[1,2,4]thiadiazol-5-ylmethoxy]phenoxy}propionic acid ethyl ester

2-methyl-2-{2-methyl-4-[3-(4-trifluoromethylphenyl)[1,2,4]thiadiazol-5-ylmethoxy]phenoxy}propionic acid ethyl ester

2-[4-(3-cyano-4-nitrophenoxy)-2-methylphenoxy]-2-methylpropionic acid ethyl ester

ethyl 2-[(4-{[3-(6-bromo-3-methyl-1-benzothien-2-yl)propyl]oxy}-2-methylphenyl)oxy]-2-methylpropanoate

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