Ethanone, 1-[5-(1-methyl-1H-benzimidazol-2-yl)-2-furanyl]-

Base Information

• Chemical Name: Ethanone, 1-[5-(1-methyl-1H-benzimidazol-2-yl)-2-furanyl]-
• CAS No.: 88422-55-3
• Molecular Formula: C₁₄H₁₂N₂O₂
• Molecular Weight: 240.261
• DSSTox Substance ID: DTXSID90349738
• Wikidata: Q82125174
• ChEMBL ID: CHEMBL1369045

Synonyms:88422-55-3;SMR000037743;MLS000038958;1-(5-(1-Methyl-1H-benzo[d]imidazol-2-yl)furan-2-yl)ethanone;Ethanone, 1-[5-(1-methyl-1H-benzimidazol-2-yl)-2-furanyl]-;HMS2189K20;1-[5-(1-methylbenzimidazol-2-yl)furan-2-yl]ethanone;cid_659045;CHEMBL1369045;BDBM51476;DTXSID90349738;STK865137;AKOS001649920;NCGC00063222-03;SR-01000478785;1-[5-(1-methylbenzimidazol-2-yl)-2-furyl]ethanone;SR-01000478785-1;1-[5-(1-methyl-2-benzimidazolyl)-2-furanyl]ethanone;1-[5-(1-methyl-1H-benzimidazol-2-yl)furan-2-yl]ethanone

Chemical Property of Ethanone, 1-[5-(1-methyl-1H-benzimidazol-2-yl)-2-furanyl]-

Chemical Property:

• PSA: 48.03000
• LogP: 3.03590
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 240.089877630
• Heavy Atom Count: 18
• Complexity: 334

Purity/Quality:

1-[5-(1-METHYLBENZIMIDAZOL-2-YL)FURAN-2-YL]ETHANONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC=C(O1)C2=NC3=CC=CC=C3N2C

Technology Process of Ethanone, 1-[5-(1-methyl-1H-benzimidazol-2-yl)-2-furanyl]-

There total 2 articles about Ethanone, 1-[5-(1-methyl-1H-benzimidazol-2-yl)-2-furanyl]- 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: 61.0%

1-(2-furyl)-1-ethanone (1192-62-7,80145-44-4) + 1-Methylbenzimidazole (1632-83-3) → 1-methyl-2-(5'-acetyl-2'-furyl)benzimidazole (88422-55-3)

Guidance literature:

With C₁₅H₁₀ClN₃OPd; silver(I) acetate; In dimethyl sulfoxide; at 110 ℃; for 16h;

DOI:10.1021/acs.organomet.9b00695

Reference yield: 52.0%

1-methyl-2-(2'-furyl)benzimidazole (6528-76-3) + acetic acid (64-19-7,77671-22-8) → 1-methyl-2-(5'-acetyl-2'-furyl)benzimidazole (88422-55-3) + 1,3,5-tris<2'-(1-methyl-2-benzimidazolyl)-5'-furyl>benzene (88422-56-4)

Guidance literature:

With PPA; at 110 ℃; for 6h;

DOI:10.1007/BF00505746

upstream raw materials:

1-methyl-2-(2'-furyl)benzimidazole

acetic acid

1-(2-furyl)-1-ethanone

1-Methylbenzimidazole

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