4-Methylsulfinylaniline

Base Information

• Chemical Name: 4-Methylsulfinylaniline
• CAS No.: 22865-62-9
• Molecular Formula: C₇H₉NOS
• Molecular Weight: 155.221
• European Community (EC) Number: 870-313-2
• Nikkaji Number: J380.976E
• Mol file: 22865-62-9.mol

Synonyms:4-methanesulfinylaniline;4-Methylsulfinylaniline;22865-62-9;4-(Methylsulfinyl)aniline;p-methylsulfinylaniline;SCHEMBL514595;4-(methanesulfinyl)phenylamine;SCHEMBL8811624;SULNLNVYOGZGNK-UHFFFAOYSA-N;AKOS008143815;CS-0376030;FT-0716065;EN300-51157;F83888;Z609944508

Chemical Property of 4-Methylsulfinylaniline

Chemical Property:

• Boiling Point: 353.9±25.0 °C(Predicted)
• PKA: 2.73±0.10(Predicted)
• Density: 1.28±0.1 g/cm3(Predicted)
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 155.04048508
• Heavy Atom Count: 10
• Complexity: 130

Purity/Quality:

99% ^*data from raw suppliers

4-methanesulfinylaniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CS(=O)C1=CC=C(C=C1)N

Technology Process of 4-Methylsulfinylaniline

There total 9 articles about 4-Methylsulfinylaniline 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%

4-methylsulfanylaniline (104-96-1) → 4-(methylsulfinyl)aniline (22865-62-9,35041-08-8,35041-09-9)

Guidance literature:

With 1,3-dimethylalloxan; dihydrogen peroxide; magnesium sulfate; In dichloromethane; at 25 ℃; for 0.5h;

DOI:10.1021/acscatal.9b04508

Reference yield: 25.0%

p-nitrophenyl methyl sulfoxide (940-12-5) → 4-(methylsulfinyl)aniline (22865-62-9,35041-08-8,35041-09-9)

Guidance literature:

With baker's yeast; In ethanol; water; at 32 ℃; for 48h;

DOI:10.1016/0040-4039(94)80139-8

Reference yield: 24.0%

1-methanesulfonyl-4-nitrobenzene (2976-30-9) → 4-methanesulfonylphenylamine (5470-49-5) + 4-(methylsulfinyl)aniline (22865-62-9,35041-08-8,35041-09-9)

Guidance literature:

With iron(III) chloride; pyrographite; hydrazine hydrate; In ethanol; for 4h; Heating; standing 2 weeks;

DOI:10.1135/cccc19850519

upstream raw materials:

1-methanesulfonyl-4-nitrobenzene

isoaalloxazine hydroperoxide

4-methylsulfanylaniline

p-nitrophenyl methyl sulfoxide

Downstream raw materials:

4-methylsulfanylaniline

trans-p-Methylsulphinylcinnamamidoxime

trans-p-Methylsulfinylcinnamonitril

Refernces

• 1、 D?ren, René,Hartmann, Jens,Leibauer, Benjamin,Panth?fer, Martin,Mondeshki, Mihail,Tremel, Wolfgang. "Magneli-type tungsten oxide nanorods as catalysts for the selective oxidation of organic sulfides". . p. 14027 - 14037. Retrieved 2021/10/19.
• 2、 Fu, Yanghe,Qi, Yanyan,Tu, Gaomei,Xu, Qionghao,Zhang, Fumin,Zhu, Weidong. "Vanadium oxides anchored on nitrogen-incorporated carbon: An efficient heterogeneous catalyst for the selective oxidation of sulfide to sulfoxide". . . Retrieved 2020/07/10.