Phenyl(benzeneseleno)sulfonate

Base Information

• Chemical Name: Phenyl(benzeneseleno)sulfonate
• CAS No.: 60805-71-2
• Molecular Formula: C12 H10 O2 S Se
• Molecular Weight: 297.236
• Hs Code.: 2916399090
• DSSTox Substance ID: DTXSID00502615
• Nikkaji Number: J888.879E
• Wikidata: Q82355802
• Mol file: 60805-71-2.mol

Synonyms:PHENYL(BENZENESELENO)SULFONATE;60805-71-2;phenylselanylsulfonylbenzene;Se-Phenyl benzenesulfonoselenoate;DTXSID00502615;AKOS025212416

Chemical Property of Phenyl(benzeneseleno)sulfonate

Chemical Property:

• Melting Point: 56-58 °C(Solv: methanol (67-56-1))
• Boiling Point: 421.6±28.0 °C(Predicted)
• PSA: 42.52000
• LogP: 2.48580
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 297.95667
• Heavy Atom Count: 16
• Complexity: 296

Purity/Quality:

97% ^*data from raw suppliers

PHENYL(BENZENESELENO)SULFONATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)S(=O)(=O)[Se]C2=CC=CC=C2

Technology Process of Phenyl(benzeneseleno)sulfonate

There total 12 articles about Phenyl(benzeneseleno)sulfonate 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: 94.0%

diphenyl diselenide (1666-13-3) + Benzenesulfinic acid (618-41-7) → phenylselenyl benzenesulfonate (60805-71-2)

Guidance literature:

With lithium perchlorate; In acetonitrile; at 20 ℃; for 0.666667h; Electrochemical reaction;

DOI:10.1002/adsc.201900047

Reference yield: 88.0%

benzeneseleninic acid (6996-92-5) + benzenesufonyl hydrazide (80-17-1) → phenylselenyl benzenesulfonate (60805-71-2)

Guidance literature:

In dichloromethane; for 0.5h;

DOI:10.1016/0040-4039(80)80005-0

Reference yield: 81.0%

diphenyl diselenide (1666-13-3) + sodium benzenesulfonate (873-55-2) → phenylselenyl benzenesulfonate (60805-71-2)

Guidance literature:

With bis-[(trifluoroacetoxy)iodo]benzene; In dichloromethane; for 0.75h; Ambient temperature;

DOI:10.1016/S0040-4039(00)78362-6

upstream raw materials:

Phenyl benzenesulfinylsulfonate

benzeneseleninic acid

diphenyl diselenide

sodium benzenesulfonate

Downstream raw materials:

(E)-2-(phenylsulfonyl)-1,3-decadiene

trans-1-(phenylsulfonyl)-3-<(tert-butyldimethylsilyl)oxy>-1-propene

[((E)-Nona-1,3-diene)-2-sulfonyl]-benzene

(1S,4R,5R,6R)-5-Benzenesulfonyl-6-phenylselanyl-7-oxa-bicyclo[2.2.1]heptan-2-one