Benzenebutanoic acid, (methylsulfinyl)methyl ester

Base Information

• Chemical Name: Benzenebutanoic acid, (methylsulfinyl)methyl ester
• CAS No.: 89578-16-5
• Molecular Formula: C12H16O3S
• Molecular Weight: 240.323
• Mol file: 89578-16-5.mol

Synonyms:

Chemical Property of Benzenebutanoic acid, (methylsulfinyl)methyl ester

Chemical Property:

• Boiling Point: 428.5±38.0 °C(Predicted)
• PSA: 62.58000
• Density: 1.194±0.06 g/cm3(Predicted)
• LogP: 2.75420

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Benzenebutanoic acid, (methylsulfinyl)methyl ester

There total 2 articles about Benzenebutanoic acid, (methylsulfinyl)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: 88.0%

(methylthio)methyl 4-phenylbutanoate (89578-12-1) → (methylsulfinyl)methyl 4-phenylbutanoate (89578-16-5)

Guidance literature:

With sodium periodate; In methanol; water;

DOI:10.1021/ja00322a036

Reference yield:

4-Phenylbutyric acid (1821-12-1) → (methylsulfinyl)methyl 4-phenylbutanoate (89578-16-5)

Guidance literature:

Multi-step reaction with 2 steps

1: diisopropylethylamine / 1,2-dimethoxy-ethane

2: 88 percent / NaIO₄ / methanol; H₂O

With sodium periodate; N-ethyl-N,N-diisopropylamine; In methanol; 1,2-dimethoxyethane; water;

DOI:10.1021/ja00322a036

Reference yield:

(methylsulfinyl)methyl 4-phenylbutanoate (89578-16-5) + (2E)-3-phenyl-2-propen-1-ol (4407-36-7) → cinnamyl 4-phenylbutyrate

Guidance literature:

With n-butyl magnesium bromide; N,N,N,N,N,N-hexamethylphosphoric triamide; Yield given. Multistep reaction; 1.) THF; 2.) THF;

DOI:10.1021/ja00322a036

upstream raw materials:

(methylthio)methyl 4-phenylbutanoate

4-Phenylbutyric acid

Downstream raw materials:

3'-phenyl-1'-propyl 4-phenylbutyrate

Refernces