2-(2-thienyl)-1H-phenanthro[9,10-d]imidazole

Base Information

• Chemical Name: 2-(2-thienyl)-1H-phenanthro[9,10-d]imidazole
• CAS No.: 73042-94-1
• Molecular Formula: C₁₉H₁₂N₂S
• Molecular Weight: 300.384
• NSC Number: 184843
• DSSTox Substance ID: DTXSID60306994
• Wikidata: Q82054319
• ChEMBL ID: CHEMBL1564028
• Mol file: 73042-94-1.mol

Synonyms:2-(2-thienyl)-1H-phenanthro[9,10-d]imidazole;73042-94-1;2-thiophen-2-yl-1H-phenanthro[9,10-d]imidazole;2-(thiophen-2-yl)-1H-phenanthro[9,10-d]imidazole;NSC184843;MLS000546715;CHEMBL1564028;DTXSID60306994;HMS2386D22;STK034214;AKOS001659959;NSC-184843;SMR000114576;2-(2-thienyl)phenanthro[9,10-d]imidazole;AI-942/13332163

Chemical Property of 2-(2-thienyl)-1H-phenanthro[9,10-d]imidazole

Chemical Property:

• Vapor Pressure: 7.24E-14mmHg at 25°C
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 300.07211956
• Heavy Atom Count: 22
• Complexity: 414

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

2-THIOPHEN-2-YL-1H-PHENANTHRO[9,10-D]IMIDAZOLE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2NC(=N4)C5=CC=CS5

Technology Process of 2-(2-thienyl)-1H-phenanthro[9,10-d]imidazole

There total 1 articles about 2-(2-thienyl)-1H-phenanthro[9,10-d]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: 91.0%

thiophene-2-carbaldehyde (98-03-3) + 9,10-phenanthrenequinone (84-11-7) → 2-(thiophen-2'-yl)-1H-phenanthro[9,10-d]imidazole (73042-94-1)

Guidance literature:

With ammonium acetate; acetic acid; at 100 ℃; for 1h;

DOI:10.1016/j.dyepig.2012.01.011

Reference yield: 68.0%

2-(thiophen-2'-yl)-1H-phenanthro[9,10-d]imidazole (73042-94-1) + diphenyl acetylene (501-65-5) → 4,5-diphenylphenanthro[9',10':4,5]imidazo[1,2-a]thieno[2,3-c]pyridine (1602990-96-4)

Guidance literature:

With dichloro(pentamethylcyclopentadienyl)rhodium (III) dimer; copper(II) acetate dihydrate; In acetone; at 120 ℃; for 12h; Inert atmosphere; Sealed tube;

DOI:10.1021/jo500401n

Reference yield:

2-(thiophen-2'-yl)-1H-phenanthro[9,10-d]imidazole (73042-94-1) → [5-(1-methyl-1H-phenanthro[9,10-d]imidazol-2-yl)-thiophen-2-yl]-phenyl-methanone

Guidance literature:

Multi-step reaction with 2 steps

1: 95 percent / KOH / dimethylsulfoxide / 1.5 h / 30 °C

2: 40 percent / PPA / 110 - 130 °C

With potassium hydroxide; In dimethyl sulfoxide;

DOI:10.1023/A:1019623408687

upstream raw materials:

thiophene-2-carbaldehyde

9,10-phenanthrenequinone

Downstream raw materials:

4,5-diphenylphenanthro[9',10':4,5]imidazo[1,2-a]thieno[2,3-c]pyridine