1-cyclohexyl-1H-imidazole

Base Information

• Chemical Name: 1-cyclohexyl-1H-imidazole
• CAS No.: 67768-61-0
• Molecular Formula: C9H14N2
• Molecular Weight: 150.224
• Hs Code.: 2933290090
• DSSTox Substance ID: DTXSID00449112
• Nikkaji Number: J599.122F
• Wikidata: Q82268464
• Mol file: 67768-61-0.mol

Synonyms:1-cyclohexyl-1H-imidazole;67768-61-0;1-cyclohexylimidazole;MFCD14707911;SCHEMBL285095;DTXSID00449112;2-(1h-imidazol-1-yl)cyclohexane;AKOS009604087;DS-7389;SY029765;CS-0060792;W17294;AB01006937-01;W-205651

Chemical Property of 1-cyclohexyl-1H-imidazole

Chemical Property:

• Boiling Point: 302.9±11.0 °C(Predicted)
• PKA: 7.21±0.10(Predicted)
• PSA: 17.82000
• Density: 1.10±0.1 g/cm3(Predicted)
• LogP: 2.38830
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 150.115698455
• Heavy Atom Count: 11
• Complexity: 119

Purity/Quality:

98% ^*data from raw suppliers

1-Cyclohexyl-1H-imidazole 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)N2C=CN=C2

Technology Process of 1-cyclohexyl-1H-imidazole

There total 4 articles about 1-cyclohexyl-1H-imidazole 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: 80.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + Glyoxal (131543-46-9,107-22-2) + cyclohexylamine (108-91-8,157973-60-9) → N-cyclohexylimidazole (67768-61-0)

Guidance literature:

With ammonia; In methanol; water; at 50 - 75 ℃; for 3h;

DOI:10.2174/157017810791514850

Reference yield: 55.0%

1H-imidazole (288-32-4) + C13H17N2O2S(1-)*Na(1+) → N-cyclohexylimidazole (67768-61-0)

Guidance literature:

With copper acetylacetonate; tetrabutylammomium bromide; In toluene; at 85 ℃; for 36h;

DOI:10.1016/j.tet.2004.08.009

Reference yield: 44.0%

→ N-cyclohexylimidazole (67768-61-0)

Guidance literature:

upstream raw materials:

formaldehyd

Glyoxal

cyclohexylamine

1H-imidazole

Downstream raw materials:

1-(((S)-4',5'-dihydro-2'-(1-adamantyl)-4'-oxazolyl)ethyl)-3-cyclohexylimidazolium iodide

1-(cyclohexyl)-3-ferrocenylethylimidazolium iodide

1-(1-cyclohexyl-1H-imidazol-2-yl)-2,2-dimethylpropan-1-ol

1-(1-cyclohexyl-1H-imidazol-2-yl)-1-phenylethanol

Refernces

• 1、 Martinez, Regina,Torregrosa, Rosario,Pastor, Isidro M.,Yus, Miguel. "Isoprene as lithiation mediator: Synthesis of 2-substituted 1-alkylimidazole derivatives". experimental part. p. 2630 - 2638. Retrieved 2012/09/07.
• 2、 -. "Cycloalkyl heterocycles for treating Hepatitis C virus". Page/Page column 37. . Retrieved 2010/02/11.