2-Iodo-2-phenylvinyl 4-methylphenyl sulfone

Base Information

• Chemical Name: 2-Iodo-2-phenylvinyl 4-methylphenyl sulfone
• CAS No.: 22183-12-6
• Molecular Formula: C15H13IO2S
• Molecular Weight: 384.238
• NSC Number: 196530
• Nikkaji Number: J3.190.523K
• Mol file: 22183-12-6.mol

Synonyms:22183-12-6;2-iodo-2-phenylvinyl 4-methylphenyl sulfone;1-[(E)-2-iodo-2-phenylethenyl]sulfonyl-4-methylbenzene;NSC196530;Benzene, 1-[[(1E)-2-iodo-2-phenylethenyl]sulfonyl]-4-methyl-;AKOS024432294;NSC-196530;AO-164/42302578;1-{[(E)-2-iodo-2-phenylethenyl]sulfonyl}-4-methylbenzene

Chemical Property of 2-Iodo-2-phenylvinyl 4-methylphenyl sulfone

Chemical Property:

• Vapor Pressure: 5.21E-09mmHg at 25°C
• Boiling Point: 482.8°Cat760mmHg
• Flash Point: 245.8°C
• Density: 1.61g/cm³
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 383.96810
• Heavy Atom Count: 19
• Complexity: 408

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)C=C(C2=CC=CC=C2)I
• Isomeric SMILES: CC1=CC=C(C=C1)S(=O)(=O)/C=C(\C2=CC=CC=C2)/I

Technology Process of 2-Iodo-2-phenylvinyl 4-methylphenyl sulfone

There total 20 articles about 2-Iodo-2-phenylvinyl 4-methylphenyl sulfone 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: 95.0%

phenylacetylene (536-74-3) + toluene-4-sulfonic acid hydrazide (1576-35-8) → (E)-1-((2-iodo-2-phenylvinyl)sulfonyl)-4-methylbenzene (22183-12-6)

Guidance literature:

With dihydrogen peroxide; potassium iodide; In water; at 100 ℃; for 2h; Sealed tube; Green chemistry;

DOI:10.1002/adsc.201801258

Reference yield: 94.0%

sodium 4-methylbenzenesulfinate (824-79-3) + phenylacetylene (536-74-3) → (E)-1-((2-iodo-2-phenylvinyl)sulfonyl)-4-methylbenzene (22183-12-6)

Guidance literature:

With di-tert-butyl peroxide; iodine; In ethanol; water; at 60 ℃; for 2h; Green chemistry;

DOI:10.1080/10426507.2016.1259622

Reference yield: 93.0%

(E)-(2-iodo-2-phenylvinyl)(p-tolyl)sulfane → (E)-1-((2-iodo-2-phenylvinyl)sulfonyl)-4-methylbenzene (22183-12-6)

Guidance literature:

With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; for 6h; Reflux;

DOI:10.1021/acs.orglett.5b01488

upstream raw materials:

p-toluenesulfonyl iodide

phenylacetylene

sodium 4-methylbenzenesulfinate

toluene-4-sulfonic acid hydrazide

Downstream raw materials:

E-2,4-diphenyl-1-(4'-tolylsulfonyl)but-1-en-3-yne

(Z)-1-methyl-4-(styrylsulfonyl)benzene

1-methyl-4-((phenylethynyl)sulfonyl)benzene

1-(2,2-diphenyl-ethenesulfonyl)-4-methyl-benzene