1H-Imidazole, 1,1'-(1,4-phenylene)bis-

Base Information

• Chemical Name: 1H-Imidazole, 1,1'-(1,4-phenylene)bis-
• CAS No.: 25372-07-0
• Molecular Formula: C12H10 N4
• Molecular Weight: 210.238
• DSSTox Substance ID: DTXSID30180021
• Nikkaji Number: J2.175.419F
• Wikidata: Q83050524
• ChEMBL ID: CHEMBL1923919
• Mol file: 25372-07-0.mol

Synonyms:25372-07-0;1,4-Di(1H-imidazol-1-yl)benzene;1H-Imidazole, 1,1'-(1,4-phenylene)bis-;1-(4-imidazol-1-ylphenyl)imidazole;1,1'-(1,4-Phenylene)bis-1H-imidazole;YSWG124;1,4-bis(1-imidazolyl)benzene;SCHEMBL2532397;CHEMBL1923919;1,4-bis(imidazol-1-yl)benzene;DTXSID30180021;MFCD23103179;AKOS040767953;BS-45586;CS-0110404;D5767;E85564;1-[4-(1H-imidazol-1-yl)phenyl]-1H-imidazole

Chemical Property of 1H-Imidazole, 1,1'-(1,4-phenylene)bis-

Chemical Property:

• Melting Point: 216-217 °C
• Boiling Point: 419.4°Cat760mmHg
• PKA: 5.53±0.10(Predicted)
• Flash Point: 207.5°C
• PSA: 35.64000
• Density: 1.22g/cm³
• LogP: 2.05800
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 210.090546336
• Heavy Atom Count: 16
• Complexity: 201

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1N2C=CN=C2)N3C=CN=C3

Technology Process of 1H-Imidazole, 1,1'-(1,4-phenylene)bis-

There total 3 articles about 1H-Imidazole, 1,1'-(1,4-phenylene)bis- 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: 95.0%

1H-imidazole (288-32-4) + 1.4-dibromobenzene (106-37-6) → 1,4-bis-(1H-imidazol-1-yl)benzene (25372-07-0)

Guidance literature:

With copper(I) oxide; 4,7-dimethoxy-1,10-phenanthroline; caesium carbonate; In 1-methyl-pyrrolidin-2-one; at 110 ℃; for 30h;

DOI:10.1021/ol0608505

Reference yield: 91.0%

1H-imidazole (288-32-4) + para-diiodobenzene (624-38-4,1032416-46-8) → 1,4-bis-(1H-imidazol-1-yl)benzene (25372-07-0)

Guidance literature:

With copper(l) iodide; salicylaldehyde-oxime; caesium carbonate; In acetonitrile; at 80 ℃; for 24h; Inert atmosphere;

DOI:10.1002/anie.201101672

Reference yield: 45.0%

1H-imidazole (288-32-4) + bromochlorobenzene (106-39-8) → 1-(4-chlorophenyl)imidazole (51581-54-5) + 1,4-bis-(1H-imidazol-1-yl)benzene (25372-07-0)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 152 ℃; for 32h;

DOI:10.1016/j.tet.2014.04.003

upstream raw materials:

1H-imidazole

para-diiodobenzene

1.4-dibromobenzene

bromochlorobenzene