2-(4-cyclohexylphenyl)-1H-indole

Base Information

• Chemical Name: 2-(4-cyclohexylphenyl)-1H-indole
• CAS No.: 52047-58-2
• Molecular Formula: C20H21N
• Molecular Weight: 275.393
• DSSTox Substance ID: DTXSID70368164
• Wikidata: Q82154521
• Mol file: 52047-58-2.mol

Synonyms:2-(4-cyclohexylphenyl)-1H-indole;1H-Indole, 2-(4-cyclohexylphenyl)-;52047-58-2;Oprea1_496558;DTXSID70368164;AKOS001027456;Z56823604

Chemical Property of 2-(4-cyclohexylphenyl)-1H-indole

Chemical Property:

• Melting Point: 206 °C(Solv: ethanol (64-17-5); benzene (71-43-2))
• Boiling Point: 310-315 °C(Press: 20 Torr)
• PSA: 15.79000
• Density: 1.108±0.06 g/cm3(Predicted)
• LogP: 5.88260
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 275.167399674
• Heavy Atom Count: 21
• Complexity: 325

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)C2=CC=C(C=C2)C3=CC4=CC=CC=C4N3

Technology Process of 2-(4-cyclohexylphenyl)-1H-indole

There total 3 articles about 2-(4-cyclohexylphenyl)-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: 85.0%

2-bromo-1-(4-cyclohexylphenyl)ethanone (99433-28-0) + aniline (62-53-3) → 2-(4-cyclohexylphenyl)-1H-indole (52047-58-2)

Guidance literature:

With N-methylimidazolium trifluoromethanesulfonate ionic liquid supported on nano-silica; In neat (no solvent); at 110 ℃; for 0.666667h; Green chemistry;

DOI:10.1007/s13738-015-0603-2

Reference yield:

4-cyclohexylacetophenone (18594-05-3) + phenylhydrazine (100-63-0) → 2-(4-cyclohexylphenyl)-1H-indole (52047-58-2)

Guidance literature:

at 120 ℃; Erhitzen des Reaktionsprodukts mit Zinkchlorid auf 200grad;

Reference yield:

→ 2-(4-cyclohexylphenyl)-1H-indole (52047-58-2)

Guidance literature:

entspr.Benzol, 1)AcCl/AlCl3 2)PhNHNH2;

upstream raw materials:

4-cyclohexylacetophenone

phenylhydrazine

2-bromo-1-(4-cyclohexylphenyl)ethanone

aniline