2,3-Bis(phenylsulfanyl)-1H-indole

Base Information

• Chemical Name: 2,3-Bis(phenylsulfanyl)-1H-indole
• CAS No.: 70291-88-2
• Molecular Formula: C20H15NS2
• Molecular Weight: 333.478
• DSSTox Substance ID: DTXSID10501659
• Nikkaji Number: J417.302C
• Wikidata: Q82354161
• Mol file: 70291-88-2.mol

Synonyms:2,3-Bis(phenylsulfanyl)-1H-indole;2,3-bis-phenylthioindole;70291-88-2;SCHEMBL10735550;DTXSID10501659

Chemical Property of 2,3-Bis(phenylsulfanyl)-1H-indole

Chemical Property:

• XLogP3: 6.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 333.06459183
• Heavy Atom Count: 23
• Complexity: 363

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)SC2=C(NC3=CC=CC=C32)SC4=CC=CC=C4

Technology Process of 2,3-Bis(phenylsulfanyl)-1H-indole

There total 17 articles about 2,3-Bis(phenylsulfanyl)-1H-indole 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: 90.0%

3-phenylthioindole (54491-43-9) + diphenyldisulfane (882-33-7) → 2,3-bis-phenyl-sulphenylindole (70291-88-2)

Guidance literature:

With trichloroisocyanuric acid; magnesium oxide; In ethyl acetate; for 4.5h;

DOI:10.1016/j.tet.2012.09.022

Reference yield: 86.0%

indole (120-72-9) + sodium benzenesulfonate (873-55-2) → 2,3-bis-phenyl-sulphenylindole (70291-88-2)

Guidance literature:

With iodine; triphenylphosphine; In water; Reflux; Schlenk technique; Inert atmosphere; Green chemistry;

DOI:10.1002/cjoc.201800164

Reference yield: 80.0%

indole (120-72-9) + thiophenol (108-98-5) → 2,3-bis-phenyl-sulphenylindole (70291-88-2)

Guidance literature:

With tert.-butylhydroperoxide; iodine; In acetonitrile; at 60 ℃; regioselective reaction;

DOI:10.1016/j.tet.2015.09.070

upstream raw materials:

1-(2-phenylsulfonylethyl)-2,3-diphenylthioindole

indole

diphenyldisulfane

3-phenylthioindole

Downstream raw materials:

1-Benzyl-2,3-bis-phenylsulfonylindole

(2,3-Bis-benzenesulfonyl-indol-1-yl)-acetonitrile

5-chloro-2-(methylthio)-1H-indole

1-benzyl-2,3-bis(phenylthio)indole