1H-Indole, 2-iodo-1-methyl-

Base Information

• Chemical Name: 1H-Indole, 2-iodo-1-methyl-
• CAS No.: 75833-63-5
• Molecular Formula: C9H8IN
• Molecular Weight: 257.074
• DSSTox Substance ID: DTXSID20453953
• Nikkaji Number: J1.400.811J
• Wikidata: Q82275255
• Mol file: 75833-63-5.mol

Synonyms:2-Iodo-1-methyl-1H-indole;75833-63-5;1H-Indole, 2-iodo-1-methyl-;2-IODO-1-METHYLINDOLE;2-iodo-n-methylindole;1-methyl-2-iodoindole;1-Methyl-2-iodo-1H-indole;1h-indole,2-iodo-1-methyl-;SCHEMBL4177987;DTXSID20453953;IGRGNTREXMXYAP-UHFFFAOYSA-N;MFCD13177457;DS-19854;Y10946;A917790

Chemical Property of 1H-Indole, 2-iodo-1-methyl-

Chemical Property:

• Melting Point: 76-77 °C
• Boiling Point: 325.3±15.0 °C(Predicted)
• PSA: 4.93000
• Density: 1.73±0.1 g/cm3(Predicted)
• LogP: 2.78290
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 256.97015
• Heavy Atom Count: 11
• Complexity: 149

Purity/Quality:

98%, ^*data from raw suppliers

2-Iodo-1-methyl-1H-indole 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2=CC=CC=C2C=C1I

Technology Process of 1H-Indole, 2-iodo-1-methyl-

There total 8 articles about 1H-Indole, 2-iodo-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: 100.0%

2-iodo-1H-indole (26340-49-8) + methyl iodide (74-88-4) → 2-iodo-1-methyl-1H-indole (75833-63-5)

Guidance literature:

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

DOI:10.1016/S0040-4039(97)10088-0

Reference yield: 100.0%

2-iodo-1H-indole (26340-49-8) → 2-iodo-1-methyl-1H-indole (75833-63-5)

Guidance literature:

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

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

Reference yield: 79.0%

C48H64MgN8Na2 → 2-iodo-1-methyl-1H-indole (75833-63-5)

Guidance literature:

With iodine; In tetrahydrofuran; at 20 ℃; Schlenk technique; Inert atmosphere;

DOI:10.1002/ejic.201701317

upstream raw materials:

1-methylindole

2-iodo-1H-indole

methyl iodide

indole

Downstream raw materials:

1-methyl-2-(2-phenylethynyl)-1H-indole

1-methylindole

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

2-bromo-1-methyl-1H-indole