2-(METHYLSULFINYL)BENZENECARBOXYLIC ACID

Base Information

• Chemical Name: 2-(METHYLSULFINYL)BENZENECARBOXYLIC ACID
• CAS No.: 19093-34-6
• Molecular Formula: C8H8 O3 S
• Molecular Weight: 184.216
• Hs Code.: 2930909899
• Mol file: 19093-34-6.mol

Synonyms:Benzoicacid, o-(methylsulfinyl)- (6CI,7CI,8CI); (?à)-2-(Methylsulfinyl)benzoic acid;2-(Methylsulfinyl)benzoic acid; NSC 266227; o-(Methylsulfinyl)benzoic acid;o-Carboxyphenyl methyl sulfoxide

Chemical Property of 2-(METHYLSULFINYL)BENZENECARBOXYLIC ACID

Chemical Property:

• Vapor Pressure: 2.06E-07mmHg at 25°C
• Melting Point: 166-170°C
• Boiling Point: 408.7°Cat760mmHg
• PKA: 3.10±0.10(Predicted)
• Flash Point: 201°C
• PSA: 73.58000
• Density: 1.44g/cm³
• LogP: 1.98790

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-(Methylsulfinyl)benzenecarboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22-41

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 2-(METHYLSULFINYL)BENZENECARBOXYLIC ACID

There total 3 articles about 2-(METHYLSULFINYL)BENZENECARBOXYLIC ACID 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: 100.0%

2-(methylthio)benzoic acid (3724-10-5) → 2-(methylsulfinyl)benzoic acid (19093-34-6)

Guidance literature:

With ferric(III) bromide; nitric acid; In acetonitrile; at 20 ℃; for 1h; chemoselective reaction;

DOI:10.1039/b815986f

Reference yield: 90.0%

C28H23N4O3RuS(1+)*F6P(1-) → 2-(methylsulfinyl)benzoic acid (19093-34-6)

Guidance literature:

With trifluoroacetic acid; In acetonitrile; at 80 ℃; for 2h; Inert atmosphere;

DOI:10.1002/cplu.201402243

Reference yield:

→ 2-(methylsulfinyl)benzoic acid (19093-34-6)

Guidance literature:

DOI:10.1021/jm00228a012 DOI:10.1016/0040-4020(62)80026-X DOI:10.1016/S0040-4039(00)70811-2

upstream raw materials:

2-(methylthio)benzoic acid

Downstream raw materials:

2-(methylthio)benzoic acid

cis-[Pt(PPh₃)2(2-(methylsulfinyl)benzoate)2]

2-methylsulfonylbenzoyl chloride

2-(methylsulfonyl)benzoic acid

Refernces

• 1、 -. "Method for preparing 2-(methylsulfinyl)benzoic acid". Paragraph 0018-0031. . Retrieved 2020/11/24.
• 2、 Kinen, Claudio Omar,Rossi, Laura Isabel,De Rossi, Rita Hoyos. "The development of an environmentally benign sulfide oxidation procedure and its assessment by green chemistry metrics". experimental part. p. 223 - 228. Retrieved 2010/04/22.