Methyl 3-(4-methoxyphenyl)-2,2-dimethylpropanoate

Base Information

• Chemical Name: Methyl 3-(4-methoxyphenyl)-2,2-dimethylpropanoate
• CAS No.: 14248-23-8
• Molecular Formula: C₁₃H₁₈O₃
• Molecular Weight: 222.284
• DSSTox Substance ID: DTXSID201245867
• Nikkaji Number: J2.745.706A
• Mol file: 14248-23-8.mol

Synonyms:methyl 3-(4-methoxyphenyl)-2,2-dimethylpropanoate;SCHEMBL13903099;DTXSID201245867;14248-23-8;Methyl 4-methoxy-alpha,alpha-dimethylbenzenepropanoate;3-(4-methoxyphenyl)-2,2-dimethyl-propionic acid methyl ester;alpha,alpha-Dimethyl-4-methoxybenzenepropanoic acid methyl ester

Chemical Property of Methyl 3-(4-methoxyphenyl)-2,2-dimethylpropanoate

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 222.125594432
• Heavy Atom Count: 16
• Complexity: 227

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(CC1=CC=C(C=C1)OC)C(=O)OC

Technology Process of Methyl 3-(4-methoxyphenyl)-2,2-dimethylpropanoate

There total 9 articles about Methyl 3-(4-methoxyphenyl)-2,2-dimethylpropanoate 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: 99.0%

p-methoxybenzyl acetate (104-21-2) + tert-butyl((1-methoxy-2-methylprop-1-en-1-yl)oxy)dimethylsilane (89337-62-2) → methyl 3-(4-methoxyphenyl)-2,2-dimethylpropanoate (14248-23-8)

Guidance literature:

With magnesium bis(trifluoromethane solfonyl)imide; In dichloromethane; for 1h; Ambient temperature;

DOI:10.1016/S0040-4039(97)00441-3

Reference yield: 92.0%

1-methoxy-2-methyl-1-trimethylsiloxy-1-propene (31469-15-5) + 5-[(4-methoxybenzyl)sulfanyl]-1-phenyl-1H-tetrazole (127866-65-3) → methyl 3-(4-methoxyphenyl)-2,2-dimethylpropanoate (14248-23-8)

Guidance literature:

With silver trifluoromethanesulfonate; In dichloromethane; for 2h; Ambient temperature;

DOI:10.1016/S0040-4039(00)94388-0

Reference yield: 83.0%

1-methoxy-2-methyl-1-trimethylsiloxy-1-propene (31469-15-5) + p-methoxybenzyl chloride (824-94-2) → methyl 3-(4-methoxyphenyl)-2,2-dimethylpropanoate (14248-23-8)

Guidance literature:

With indium(III) bromide; In dichloromethane; at 20 ℃; for 2h;

DOI:10.1021/ol701684n

upstream raw materials:

1-methoxy-2-methyl-1-trimethylsiloxy-1-propene

5-[(4-methoxybenzyl)sulfanyl]-1-phenyl-1H-tetrazole

4-Methoxybenzyl alcohol

p-methoxybenzyl acetate

Downstream raw materials:

3-(4-methoxybenzyl)-3-methyl-1-(quinolin-8-yl)azetidin-2-one

3-(4-methoxybenzyl)-3-methyl-1-(8-quinolinyl)-2-azetidinone

3-(4-methoxyphenyl)-2,2-dimethyl-N-(quinolin-8-yl)propanamide

C₃₃H₄₁F₆NO₄