2-Iodo-1-(phenylsulfonyl)-1H-indole

Base Information

• Chemical Name: 2-Iodo-1-(phenylsulfonyl)-1H-indole
• CAS No.: 99275-44-2
• Molecular Formula: C14H10INO2S
• Molecular Weight: 383.209
• DSSTox Substance ID: DTXSID10440918
• Nikkaji Number: J701.996C
• Wikidata: Q82257415
• Mol file: 99275-44-2.mol

Synonyms:2-IODO-1-(PHENYLSULFONYL)-1H-INDOLE;99275-44-2;1-(BENZENESULFONYL)-2-IODOINDOLE;1h-indole,2-iodo-1-(phenylsulfonyl)-;SCHEMBL7014825;2-iodo-N-(phenylsulfonyl)indole;DTXSID10440918;1-Phenylsulfonyl-2-iodo-1H-indole;1-(benzenesulfonyl)-2-iodo-1H-indole

Chemical Property of 2-Iodo-1-(phenylsulfonyl)-1H-indole

Chemical Property:

• PSA: 47.45000
• LogP: 4.56370
• Storage Temp.: 2-8°C
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 382.94770
• Heavy Atom Count: 19
• Complexity: 414

Purity/Quality:

95+% ^*data from raw suppliers

2-IODO-1-(PHENYLSULFONYL)-1H-INDOLE 95 ^*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)N2C3=CC=CC=C3C=C2I

Technology Process of 2-Iodo-1-(phenylsulfonyl)-1H-indole

There total 10 articles about 2-Iodo-1-(phenylsulfonyl)-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: 95.0%

2-iodo-1H-indole (26340-49-8) + benzenesulfonyl chloride (98-09-9) → 2-iodo-1-(phenylsulfonyl)-1H-indole (99275-44-2)

Guidance literature:

With base;

DOI:10.1039/a905024h

Reference yield: 94.0%

2-iodo-1H-indole (26340-49-8) → 2-iodo-1-(phenylsulfonyl)-1H-indole (99275-44-2)

Guidance literature:

With potassium hydroxide; In N,N-dimethyl-formamide;

DOI:10.1016/S0040-4020(01)00360-X

Reference yield: 93.0%

1-benzenesulfonylindole (40899-71-6) → 2-iodo-1-(phenylsulfonyl)-1H-indole (99275-44-2)

Guidance literature:

With Iodine monochloride; In dichloromethane; at 20 ℃; for 1h; Inert atmosphere;

DOI:10.1016/j.tet.2012.05.053

upstream raw materials:

1-benzenesulfonylindole

2-iodo-1H-indole

benzenesulfonyl chloride

indole

Downstream raw materials:

1-phenylsulfonyl-2-(pyridin-2-yl)-1H-indole

2-phenyl-1-(phenylsulfonyl)-1H-indole

2-iodo-1H-indole

phenyl-<1-(phenylsulfonyl)-2-indolyl>methanol