[(2-Methylcyclopropyl)sulfonyl]benzene

Base Information

• Chemical Name: [(2-Methylcyclopropyl)sulfonyl]benzene
• CAS No.: 65288-16-6
• Molecular Formula: C10H12O2S
• Molecular Weight: 196.27
• DSSTox Substance ID: DTXSID80497550
• Nikkaji Number: J497.608H
• Mol file: 65288-16-6.mol

Synonyms:[(2-methylcyclopropyl)sulfonyl]benzene;65288-16-6;DTXSID80497550;(2-methyl-cyclopropyl)sulfonyl-benzene;(2-Methylcyclopropane-1-sulfonyl)benzene

Chemical Property of [(2-Methylcyclopropyl)sulfonyl]benzene

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 196.05580079
• Heavy Atom Count: 13
• Complexity: 270

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC1S(=O)(=O)C2=CC=CC=C2

Technology Process of [(2-Methylcyclopropyl)sulfonyl]benzene

There total 18 articles about [(2-Methylcyclopropyl)sulfonyl]benzene 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: 87.0%

toluene-4-sulfonic acid 3-benzenesulfonyl-1-methylpropyl ester (65288-12-2) → trans-1-phenylsulfonyl-2-methyl cyclopropane (65288-16-6,144343-11-3)

Guidance literature:

With sodium hydride; tert-butyl alcohol; In tetrahydrofuran; Heating; overnight;

DOI:10.1016/S0040-4020(97)00635-2

Reference yield: 72.0%

ethanol (64-17-5) + methylphenylsulfonate (3112-85-4) → 2-Methylcyclopropylphenylsulfon (65288-16-6)

Guidance literature:

With ruthenium(bis[2‐(ethylsulfanyl)ethyl]amine)(dichloro)(triphenylphosphine); potassium hexamethylsilazane; In toluene; at 120 ℃; for 12h; Schlenk technique; Inert atmosphere; Glovebox;

DOI:10.1021/acs.organomet.8b00361

Reference yield: 71.0%

3-methyl-3-chloropropyl phenyl sulfone → trans-1-phenylsulfonyl-2-methyl cyclopropane (65288-16-6,144343-11-3)

Guidance literature:

3-methyl-3-chloropropyl phenyl sulfone; With potassium tert-butylate; In toluene; at 0 ℃; for 1h; Inert atmosphere;

With water; ammonium chloride; In toluene;

DOI:10.1016/j.tet.2010.02.006

upstream raw materials:

toluene-4-sulfonic acid 3-benzenesulfonyl-1-methylpropyl ester

benzaldehyde

2-methyl-3-chloropropyl phenyl sulfone

thiophenol