2,2'-Sulfonylbis(1-phenylethanone)

Base Information

• Chemical Name: 2,2'-Sulfonylbis(1-phenylethanone)
• CAS No.: 3708-08-5
• Molecular Formula: C16H14 O4 S
• Molecular Weight: 302.351
• NSC Number: 82224
• DSSTox Substance ID: DTXSID00292387
• Nikkaji Number: J2.243.659G
• Wikidata: Q82030676
• Mol file: 3708-08-5.mol

Synonyms:2,2'-sulfonylbis(1-phenylethanone);3708-08-5;2-(2-oxo-2-phenylethanesulfonyl)-1-phenylethan-1-one;diphenacylsulphone;2-phenacylsulfonyl-1-phenylethanone;NSC82224;Cambridge id 5144190;IFLab1_000934;SCHEMBL1516246;DTXSID00292387;HMS1414K10;NSC-82224;AKOS024365325;2,2'-sulfonylbis(1-phenylethan-1-one);AB00074408-01;SR-01000196855;SR-01000196855-1;F0264-0038

Chemical Property of 2,2'-Sulfonylbis(1-phenylethanone)

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 302.06128010
• Heavy Atom Count: 21
• Complexity: 425

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=O)CS(=O)(=O)CC(=O)C2=CC=CC=C2

Technology Process of 2,2'-Sulfonylbis(1-phenylethanone)

There total 5 articles about 2,2'-Sulfonylbis(1-phenylethanone) 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%

diphenacyl sulfide (2461-80-5) → Diphenacyl sulfone (3708-08-5)

Guidance literature:

With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; at -78 - -20 ℃;

DOI:10.1002/ejoc.201403294

Reference yield: 30.0%

α-bromoacetophenone (70-11-1) → Diphenacyl sulfone (3708-08-5) + acetophenone (98-86-2)

Guidance literature:

With sulfur dioxide; rongalite; In N,N-dimethyl-formamide; for 18h; Ambient temperature;

DOI:10.1021/jo00259a026

Reference yield:

α-bromoacetophenone (70-11-1) → Diphenacyl sulfone (3708-08-5)

Guidance literature:

Multi-step reaction with 2 steps

2: benzene; potassium permanganate / in schwach saurer Loesung unter Kuehlung

With potassium permanganate; benzene;

upstream raw materials:

diphenacyl sulfide

α-bromoacetophenone

Downstream raw materials:

bis-(α-bromo-phenacyl)-sulfone

3,5-diphenyl-4H-[1,4]thiazine 1,1-dioxide

3,6-diphenyl-2,7-dihydro-[1,4,5]thiadiazepine 1,1-dioxide

diphenacylsulfondioxim

Refernces

• 1、 Posner, Gary H.,Wang, Dasong,Gonzalez, Lluisa,Tao, Xueliang,Cumming, Jared N.,Klinedinst, Donna,Shapiro, Theresa A.. "Mechanism-based design of simple, symmetrical, easily prepared, potent antimalarial endoperoxides". . p. 815 - 818. Retrieved 2007/10/03.