2-(4-bromophenyl)-1-methyl-1H-indole

Base Information

• Chemical Name: 2-(4-bromophenyl)-1-methyl-1H-indole
• CAS No.: 61843-42-3
• Molecular Formula: C15H12BrN
• Molecular Weight: 286.171
• DSSTox Substance ID: DTXSID30493108
• Nikkaji Number: J2.577.063C
• Wikidata: Q82339568

Synonyms:2-(4-bromophenyl)-1-methyl-1H-indole;2-(4-bromophenyl)-1-methylindole;61843-42-3;SCHEMBL8591982;DTXSID30493108;HXHHFFNBRIMCIX-UHFFFAOYSA-N;MFCD08685686;AKOS005423128;NCGC00332245-01;SY331419;AB01326354-02

Chemical Property of 2-(4-bromophenyl)-1-methyl-1H-indole

Chemical Property:

• PSA: 4.93000
• LogP: 4.60780
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 285.01531
• Heavy Atom Count: 17
• Complexity: 260

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN1C2=CC=CC=C2C=C1C3=CC=C(C=C3)Br

Technology Process of 2-(4-bromophenyl)-1-methyl-1H-indole

There total 9 articles about 2-(4-bromophenyl)-1-methyl-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: 99.0%

1-methylindole (603-76-9) + 1,4-bromoiodobenzene (589-87-7) → 1-methyl-2-(4-bromophenyl)-1H-indole (61843-42-3)

Guidance literature:

With ortho-nitrobenzoic acid; silver(l) oxide; palladium diacetate; In N,N-dimethyl-formamide; at 25 ℃; for 15h;

DOI:10.1021/ja710731a

Reference yield: 99.0%

3-(4-bromophenyl)-2-cyanooxirane + N-methylaniline (100-61-8) → 1-methyl-2-(4-bromophenyl)-1H-indole (61843-42-3)

Guidance literature:

With aluminum (III) chloride; In 2,2,2-trifluoroethanol; for 30h; Reflux;

Reference yield: 74.0%

1-methylindole (603-76-9) + sodium 4-bromobenzenesulfinate (34176-08-4) → 1-methyl-2-(4-bromophenyl)-1H-indole (61843-42-3)

Guidance literature:

With dichloro(1,5-cyclooctadiene)palladium(II); copper(II) choride dihydrate; In 1,4-dioxane; toluene; at 110 ℃; for 24h; Inert atmosphere;

DOI:10.1002/adsc.201100603

upstream raw materials:

2-(4-bromophenyl)indole

methyl iodide

1-methylindole

1,4-bromoiodobenzene

Downstream raw materials:

2-(4-Bromo-phenyl)-3-[(Z)-3-[2-(4-bromo-phenyl)-1-methyl-1H-indol-3-yl]-2-methyl-prop-2-en-(E)-ylidene]-1-methyl-3H-indolium; chloride

2-(4-Bromo-phenyl)-3-[(E)-3-[2-(4-bromo-phenyl)-1-methyl-1H-indol-3-yl]-prop-2-en-(E)-ylidene]-1-methyl-3H-indolium; chloride

3-[(Z)-2-Bromo-3-[2-(4-bromo-phenyl)-1-methyl-1H-indol-3-yl]-prop-2-en-(E)-ylidene]-2-(4-bromo-phenyl)-1-methyl-3H-indolium; chloride

2-(4-bromophenyl)-1-methyl-1H-indole-3-carbonitrile

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