1-((Diiodomethyl)sulfonyl)-4-methylbenzene

Base Information

• Chemical Name: 1-((Diiodomethyl)sulfonyl)-4-methylbenzene
• CAS No.: 20018-09-1
• Deprecated CAS: 115524-44-2,66456-97-1,66456-97-1
• Molecular Formula: C8H8I2O2S
• Molecular Weight: 422.025
• Hs Code.: 2904909090
• European Community (EC) Number: 243-468-3
• UNII: FDJ36QMI3H
• DSSTox Substance ID: DTXSID3032541
• Nikkaji Number: J76.384E
• Wikidata: Q11310933
• ChEMBL ID: CHEMBL1884140
• Mol file: 20018-09-1.mol

Synonyms:1-(diiodomethyl)sulfonyl-4-methyl benzene;diiodomethyl p-tolyl sulfone;DIMPTS

Chemical Property of 1-((Diiodomethyl)sulfonyl)-4-methylbenzene

Chemical Property:

• Vapor Pressure: 1.87E-15mmHg at 25°C
• Refractive Index: 1.751
• Boiling Point: 420.1 °C at 760 mmHg
• Flash Point: 207.9 °C
• PSA: 42.52000
• Density: 2.274 g/cm³
• LogP: 4.00310
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 421.83345
• Heavy Atom Count: 13
• Complexity: 248

Purity/Quality:

99.9% ^*data from raw suppliers

1-((Diiodomethyl)sulfonyl)-4-methylbenzene 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Other Uses -> Biocides/Disinfectants
• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)C(I)I
• Uses: 1-((Diiodomethyl)sulfonyl)-4-methylbenzene is used in method for producing aqueous solution of Diiodomethane compound-cyclodextrin derivative inclusion complex as antibacterial or antifungal agent.

Technology Process of 1-((Diiodomethyl)sulfonyl)-4-methylbenzene

There total 1 articles about 1-((Diiodomethyl)sulfonyl)-4-methylbenzene 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:

→ diiodomethyl p-tolyl sulphone (20018-09-1)

Guidance literature:

/BRN= 331311/, I2, NaOH;

Reference yield: 63.0%

diiodomethyl p-tolyl sulphone (20018-09-1) + methacrylic acid methyl ester (80-62-6,114512-63-9,143476-91-9,25188-98-1,9011-14-7) → methyl 2-iodo-1-methyl-2-tosylcyclopropane-1-carboxylate

Guidance literature:

With sodium hexamethyldisilazane; In tetrahydrofuran; at -78 ℃; for 21h;

Reference yield: 52.0%

tert-butylethylene (558-37-2) + diiodomethyl p-tolyl sulphone (20018-09-1) → 1-((1,3-diiodo-4,4-dimethylpentyl)sulfonyl)-4-methylbenzene

Guidance literature:

With dibenzoyl peroxide; In chlorobenzene; at 103 ℃; for 22h; Inert atmosphere;