5-Methylsulfonyl-2-(2,2,2-trifluoro-1-Methylethoxy)benzoic acid Methyl ester

Base Information

• Chemical Name: 5-Methylsulfonyl-2-(2,2,2-trifluoro-1-Methylethoxy)benzoic acid Methyl ester
• CAS No.: 845617-19-8
• Molecular Formula: C12H13F3O5S
• Molecular Weight: 326.293
• Mol file: 845617-19-8.mol

Synonyms:5-Methylsulfonyl-2-(2,2,2-trifluoro-1-Methylethoxy)benzoic acid Methyl ester

Chemical Property of 5-Methylsulfonyl-2-(2,2,2-trifluoro-1-Methylethoxy)benzoic acid Methyl ester

Chemical Property:

• Boiling Point: 422.8±45.0 °C(Predicted)
• PSA: 78.05000
• Density: 1.343±0.06 g/cm3(Predicted)
• LogP: 3.28710

Purity/Quality:

≥95% ^*data from raw suppliers

5-Methylsulfonyl-2-(2,2,2-trifluoro-1-methylethoxy)benzoicacidmethylester ^*data from reagent suppliers

Safty Information:

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Technology Process of 5-Methylsulfonyl-2-(2,2,2-trifluoro-1-Methylethoxy)benzoic acid Methyl ester

There total 1 articles about 5-Methylsulfonyl-2-(2,2,2-trifluoro-1-Methylethoxy)benzoic acid Methyl 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:

1,1,1-trifluoropropan-2-yl trifluoromethanesulfonate (212556-43-9) + methyl 2-hydroxy-5-(methylsulfonyl)benzoate (101371-44-2) → rac-5-Methanesulfonyl-2-(2,2,2-trifluoro-1-methyl-ethoxy)-benzoic acid methyl ester (845617-19-8)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 80 ℃; for 48h;

Reference yield:

rac-5-Methanesulfonyl-2-(2,2,2-trifluoro-1-methyl-ethoxy)-benzoic acid methyl ester (845617-19-8) → 5-Methanesulfonyl-2-((S)-2,2,2-trifluoro-1-methyl-ethoxy)-benzoic acid methyl ester (845617-20-1) + 5-methanesulfonyl-2-((R)-2,2,2-trifluoro-1-methyl-ethoxy)-benzoic acid methyl ester (845617-21-2)

Guidance literature:

In ethanol; n-heptane; Purification / work up; Resolution of racemate;

upstream raw materials:

1,1,1-trifluoropropan-2-yl trifluoromethanesulfonate

methyl 2-hydroxy-5-(methylsulfonyl)benzoate

Downstream raw materials:

5-Methanesulfonyl-2-((S)-2,2,2-trifluoro-1-methyl-ethoxy)-benzoic acid methyl ester

5-methanesulfonyl-2-((R)-2,2,2-trifluoro-1-methyl-ethoxy)-benzoic acid methyl ester

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