1-[(S)-Methanesulfinyl]-2-methoxybenzene

Base Information

• Chemical Name: 1-[(S)-Methanesulfinyl]-2-methoxybenzene
• CAS No.: 84413-73-0
• Molecular Formula: C8H10O2S
• Molecular Weight: 170.232
• DSSTox Substance ID: DTXSID80537147
• Wikidata: Q82412036
• Mol file: 84413-73-0.mol

Synonyms:1-[(S)-Methanesulfinyl]-2-methoxybenzene;84413-73-0;DTXSID80537147

Chemical Property of 1-[(S)-Methanesulfinyl]-2-methoxybenzene

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 170.04015073
• Heavy Atom Count: 11
• Complexity: 147

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC=C1S(=O)C
• Isomeric SMILES: COC1=CC=CC=C1[S@@](=O)C

Technology Process of 1-[(S)-Methanesulfinyl]-2-methoxybenzene

There total 10 articles about 1-[(S)-Methanesulfinyl]-2-methoxybenzene 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: 91.0%

1-methoxy-2-(methylsulfanyl)benzene (2388-73-0) → (S)-(-)-2-methoxyphenyl methyl sulfoxide (84413-73-0)

Guidance literature:

With phosphate buffer; dihydrogen peroxide; chiral Al(salalen); In methanol; at 20 ℃; for 24h;

DOI:10.1002/anie.200700792

Reference yield: 88.0%

→ (S)-(-)-2-methoxyphenyl methyl sulfoxide (84413-73-0)

Guidance literature:

With dihydrogen peroxide; In water; at 25 ℃; stereoselective reaction;

Reference yield: 82.0%

1-methoxy-2-(methylsulfanyl)benzene (2388-73-0) → 1-methanesulfonyl-2-methoxy-benzene (13736-79-3) + (S)-(-)-2-methoxyphenyl methyl sulfoxide (84413-73-0)

Guidance literature:

With phosphate buffer; dihydrogen peroxide; chiral Al(salalen); In methanol; at 20 ℃; for 24h;

DOI:10.1002/anie.200700792

upstream raw materials:

1-methoxy-2-(methylsulfanyl)benzene

1,2:5,6-di-O-isopropylidene-α-D-glucofuranosyl-(-)-<(S)S>-methanesulfinate

1-methylsulfinyl-2-methoxybenzene

2-[(2-methoxyphenyl)sulfanyl]ethyl phenyl sulfone