1-Cyclohexyl-5-phenylimidazole

Base Information

• Chemical Name: 1-Cyclohexyl-5-phenylimidazole
• CAS No.: 71333-68-1
• Molecular Formula: C15H18 N2
• Molecular Weight: 226.31682
• DSSTox Substance ID: DTXSID40500559
• Nikkaji Number: J3.279.569B
• Wikidata: Q82352257
• Mol file: 71333-68-1.mol

Synonyms:1-CYCLOHEXYL-5-PHENYLIMIDAZOLE;71333-68-1;1-Cyclohexyl-5-phenyl-1H-imidazole;SCHEMBL11407375;DTXSID40500559;AKOS015964855

Chemical Property of 1-Cyclohexyl-5-phenylimidazole

Chemical Property:

• Vapor Pressure: 2.98E-07mmHg at 25°C
• Refractive Index: 1.613
• Boiling Point: 431.6°C at 760 mmHg
• Flash Point: 214.8°C
• PSA: 17.82000
• Density: 1.1g/cm³
• LogP: 4.05530
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 226.146998583
• Heavy Atom Count: 17
• Complexity: 229

Purity/Quality:

98% ^*data from raw suppliers

1-CYCLOHEXYL-5-PHENYLIMIDAZOLE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)N2C=NC=C2C3=CC=CC=C3

Technology Process of 1-Cyclohexyl-5-phenylimidazole

There total 5 articles about 1-Cyclohexyl-5-phenylimidazole 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: 65.0%

cyclohexylamine (108-91-8,157973-60-9) + 3-(2-oxo-2-phenylethyl)quinazolin-4(3H)-one (60007-51-4) → anthranilic acid cyclohexylamine (56814-11-0) + 1-cyclohexyl-5-phenyl-1H-imidazole (71333-68-1)

Guidance literature:

With toluene-4-sulfonic acid; In xylene; for 12h; Heating;

DOI:10.1016/S0040-4020(01)87289-6

Reference yield: 50.0%

9-Benzyl-1-(2-oxo-2-phenyl-ethyl)-6-(2-oxo-2-phenyl-ethylamino)-9H-purin-1-ium; bromide + cyclohexylamine (108-91-8,157973-60-9) → 1-cyclohexyl-5-phenyl-1H-imidazole (71333-68-1)

Guidance literature:

With toluene-4-sulfonic acid; In xylene; for 12h;

DOI:10.1016/S0040-4039(00)98868-3

Reference yield: 41.0%

5-phenyloxazole (1006-68-4) + cyclohexylamine (108-91-8,157973-60-9) → 1-cyclohexyl-5-phenyl-1H-imidazole (71333-68-1)

Guidance literature:

With trifluoroacetic acid; In 1,2-dichloro-benzene; at 200 ℃; for 0.5h; Microwave irradiation;

DOI:10.1039/c3cc48467j

upstream raw materials:

cyclohexylamine

3-(2-oxo-2-phenylethyl)quinazolin-4(3H)-one

α-bromoacetophenone

5-phenyloxazole

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