4-Phenyl-4-(phenylsulfonyl)butan-2-one

Base Information

• Chemical Name: 4-Phenyl-4-(phenylsulfonyl)butan-2-one
• CAS No.: 62692-46-0
• Molecular Formula: C16H16O3S
• Molecular Weight: 288.367
• DSSTox Substance ID: DTXSID40386037

Synonyms:4-phenyl-4-(phenylsulfonyl)butan-2-one;62692-46-0;2-Butanone, 4-phenyl-4-(phenylsulfonyl)-;DTXSID40386037;STK952536;AKOS002218822;AKOS016245177

Chemical Property of 4-Phenyl-4-(phenylsulfonyl)butan-2-one

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 288.08201554
• Heavy Atom Count: 20
• Complexity: 410

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)CC(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2

Technology Process of 4-Phenyl-4-(phenylsulfonyl)butan-2-one

There total 9 articles about 4-Phenyl-4-(phenylsulfonyl)butan-2-one 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: 14.0%

phenylazo phenyl sulfone (14922-16-8) + (E)-benzalacetone (1896-62-4) → 1,1-diphenyl-1 buten-3-one (837-66-1) + 4,4-diphenylbutan-2-one (5409-60-9) + 4-benzenesulfonyl-4-phenyl-butan-2-one (62692-46-0) + 4-phenyl-4-phenylsulfonyl-3-buten-2-one

Guidance literature:

tetrakis(triphenylphosphine) palladium⁽⁰⁾; In benzene; at 80 ℃; for 2h; Further byproducts given;

Reference yield: 14.0%

benzene diazonium chloride (100-34-5) + (E)-benzalacetone (1896-62-4) → 4-benzenesulfonyl-4-phenyl-butan-2-one (62692-46-0) + benzenesulfonyl chloride (98-09-9)

Guidance literature:

With sulfur dioxide; In acetic acid; acetone;

Reference yield:

4-Phenylsulfonyl-4-phenyl-2-acetoxy-buten-1 (62692-56-2) → 4-benzenesulfonyl-4-phenyl-butan-2-one (62692-46-0)

Guidance literature:

With hydrogenchloride; In acetone; at 25 ℃; for 7h;

upstream raw materials:

C₁₆H₁₅ClO₂S

4-Phenylsulfonyl-4-phenyl-2-acetoxy-buten-1

4-Phenyl-4-phenylsulfanyl-butan-2-one

phenylazo phenyl sulfone

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