2-([1,1'-Biphenyl]-3-yl)-1H-imidazole

Base Information

• Chemical Name: 2-([1,1'-Biphenyl]-3-yl)-1H-imidazole
• CAS No.: 608515-10-2
• Molecular Formula: C15H12N2
• Molecular Weight: 220.27
• DSSTox Substance ID: DTXSID90702960
• Nikkaji Number: J1.946.402D
• Wikidata: Q82635000
• Mol file: 608515-10-2.mol

Synonyms:608515-10-2;2-BIPHENYL-3-YL-1H-IMIDAZOLE;2-([1,1'-Biphenyl]-3-yl)-1H-imidazole;SCHEMBL3644191;2-(3-Biphenylyl)-1H-imidazole;DTXSID90702960

Chemical Property of 2-([1,1'-Biphenyl]-3-yl)-1H-imidazole

Chemical Property:

• Boiling Point: 469.5±24.0 °C(Predicted)
• PKA: 12.96±0.12(Predicted)
• PSA: 28.68000
• Density: 1.149±0.06 g/cm3(Predicted)
• LogP: 3.74370
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 220.100048391
• Heavy Atom Count: 17
• Complexity: 235

Purity/Quality:

2-BIPHENYL-3-YL-1H-IMIDAZOLE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CC(=CC=C2)C3=NC=CN3

Technology Process of 2-([1,1'-Biphenyl]-3-yl)-1H-imidazole

There total 1 articles about 2-([1,1'-Biphenyl]-3-yl)-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: 31.0%

2-Phenylimidazole (670-96-2) + iodobenzene (591-50-4) → 2-(biphenyl-4-yl)imidazole (92437-07-5) + NSC 167196 (670-83-7) + 2-(biphenyl-3-yl)imidazole (608515-10-2)

Guidance literature:

2-Phenylimidazole; With 1,1'-bipyridyl; sodium methylate; bis(1,5-cyclooctadiene)diiridium(I) dichloride; In hexane; at 80 ℃; for 20h;

iodobenzene; With tetrakis(triphenylphosphine) palladium⁽⁰⁾; potassium carbonate; In N,N-dimethyl-formamide; at 100 ℃; for 10h;

DOI:10.1021/ja036157j

upstream raw materials:

2-Phenylimidazole

iodobenzene

Refernces