1H-Indole, 2,3-diiodo-1-methyl-

Base Information

• Chemical Name: 1H-Indole, 2,3-diiodo-1-methyl-
• CAS No.: 180623-97-6
• Molecular Formula: C9H7I2N
• Molecular Weight: 382.97
• DSSTox Substance ID: DTXSID00444561
• Nikkaji Number: J1.499.670B
• Wikidata: Q82262732
• Mol file: 180623-97-6.mol

Synonyms:180623-97-6;1H-Indole, 2,3-diiodo-1-methyl-;2,3-diiodo-N-methylindole;SCHEMBL18799866;DTXSID00444561;1-Methyl-2,3-diiodo-1H-indole;1h-indole,2,3-diiodo-1-methyl-

Chemical Property of 1H-Indole, 2,3-diiodo-1-methyl-

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 382.86679
• Heavy Atom Count: 12
• Complexity: 174

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2=CC=CC=C2C(=C1I)I

Technology Process of 1H-Indole, 2,3-diiodo-1-methyl-

There total 1 articles about 1H-Indole, 2,3-diiodo-1-methyl- 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: 48.0%

1-methyl-3-indolecarboxylic acid (32387-21-6) → 3-iodo-1-methyl-1H-indole (85092-84-8) + 2,3-diiodo-1-methyl-1H-indole (180623-97-6)

Guidance literature:

With copper(l) iodide; oxygen; palladium diacetate; In dimethyl sulfoxide; at 160 ℃; for 20h; under 760.051 Torr; Schlenk technique; Sealed tube;

DOI:10.1021/acs.joc.5b02873

Reference yield: 99.0%

2,3-diiodo-1-methyl-1H-indole (180623-97-6) → 1-methylindole (603-76-9)

Guidance literature:

2,3-diiodo-1-methyl-1H-indole; With tert.-butyl lithium; In tetrahydrofuran; pentane; at -78 ℃; for 0.333333h;

With ammonium chloride; In tetrahydrofuran; water; pentane; at -78 - 20 ℃;

DOI:10.1016/S0040-4039(01)00332-X

Reference yield: 96.0%

2,3-diiodo-1-methyl-1H-indole (180623-97-6) → 1-methyl-1H-indole-2,3-dione (2058-74-4)

Guidance literature:

With ruthenium trichloride; sodium periodate; In water; acetonitrile; at 20 ℃; for 8h;

DOI:10.1080/00304940109356623

upstream raw materials:

1-methyl-3-indolecarboxylic acid

Downstream raw materials:

5-methyl-5H-benzo-carbazole-6,11-dione

1-methylindole

1-methyl-1H-indole-2,3-dione

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