1,5-Dicyclohexylimidazole

Base Information

• Chemical Name: 1,5-Dicyclohexylimidazole
• CAS No.: 80964-44-9
• Molecular Formula: C15H24N2
• Molecular Weight: 232.369
• European Community (EC) Number: 623-034-3
• DSSTox Substance ID: DTXSID70352129
• Nikkaji Number: J1.957.000B
• Wikidata: Q82129120
• Mol file: 80964-44-9.mol

Synonyms:1,5-Dicyclohexylimidazole;80964-44-9;1,5-dicyclohexyl-1h-imidazole;SCHEMBL1184926;DTXSID70352129;1,5-Dicyclohexylimidazole, 97%;RPUYMGRFOKMRSB-UHFFFAOYSA-N;AKOS024307475;FT-0641790

Chemical Property of 1,5-Dicyclohexylimidazole

Chemical Property:

• Vapor Pressure: 1.44E-06mmHg at 25°C
• Melting Point: 114-116oC(lit.)
• Boiling Point: 410.3oC at 760 mmHg
• PKA: 7.67±0.61(Predicted)
• Flash Point: 202oC
• PSA: 17.82000
• Density: 1.13g/cm3
• LogP: 4.43600
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 232.193948774
• Heavy Atom Count: 17
• Complexity: 229

Purity/Quality:

98%Min ^*data from raw suppliers

1,5-Dicyclohexylimidazole 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)C2=CN=CN2C3CCCCC3

Technology Process of 1,5-Dicyclohexylimidazole

There total 3 articles about 1,5-Dicyclohexylimidazole 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:

[(p-methylphenyl)sulfonylmethyl]isonitrile (38622-91-2,36635-61-7) + N,1-dicyclohexylmethanimine dicyclohexyl imine (56037-75-3) → p-toluene sulfinic acid (536-57-2) + 1,5-dicyclohexyl imidazole (80964-44-9)

Guidance literature:

In methanol; Yield given; 1.) 20 h, 2.) 3 h, reflux;

DOI:10.1021/ja00289a012

Reference yield:

cyclohexylamine (108-91-8,157973-60-9) → 1,5-dicyclohexyl imidazole (80964-44-9)

Guidance literature:

Multi-step reaction with 2 steps

1: CaCl₂ / benzene / 4 h / Heating

2: methanol / 1.) 20 h, 2.) 3 h, reflux

With calcium chloride; In methanol; benzene;

DOI:10.1021/ja00289a012

Reference yield:

cyclohexanecarbaldehyde (2043-61-0) → 1,5-dicyclohexyl imidazole (80964-44-9)

Guidance literature:

Multi-step reaction with 2 steps

1: CaCl₂ / benzene / 4 h / Heating

2: methanol / 1.) 20 h, 2.) 3 h, reflux

With calcium chloride; In methanol; benzene;

DOI:10.1021/ja00289a012

upstream raw materials:

[(p-methylphenyl)sulfonylmethyl]isonitrile

N,1-dicyclohexylmethanimine dicyclohexyl imine

cyclohexylamine

cyclohexanecarbaldehyde

Downstream raw materials:

1,5-dicyclohexyl-3-(2-phenyl-2-oxoethyl)imidazolium chloride

Ru(hexyl-picnic-basket porphyrin)(1,5-dicyclohexylimidazole)out(Cl)in*0.5CHCl₃

Ru(hexyl-picnic-basket porphyrin)(1,5-dicyclohexylimidazole)out(tetrahydrofurane)in

Fe((C₄H₂NCC₆H₄O(CH₂)2OOC)4C₆H₂)((C₆H₁₁)2C₃H₂N₂)

Refernces