2-pentadecyl-1H-benzimidazole

Base Information

• Chemical Name: 2-pentadecyl-1H-benzimidazole
• CAS No.: 5805-26-5
• Molecular Formula: C₂₂H₃₆N₂
• Molecular Weight: 328.541
• European Community (EC) Number: 653-153-6
• DSSTox Substance ID: DTXSID70389354
• Nikkaji Number: J873.053I
• Mol file: 5805-26-5.mol

Synonyms:2-pentadecyl-1H-benzimidazole;5805-26-5;1H-Benzimidazole, 2-pentadecyl-;2-Pentadecyl-1H-benzo[d]imidazole;SCHEMBL6753973;DTXSID70389354;STL357178;AKOS002685241

Chemical Property of 2-pentadecyl-1H-benzimidazole

Chemical Property:

• XLogP3: 9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 14
• Exact Mass: 328.287849157
• Heavy Atom Count: 24
• Complexity: 292

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCC1=NC2=CC=CC=C2N1

Technology Process of 2-pentadecyl-1H-benzimidazole

There total 2 articles about 2-pentadecyl-1H-benzimidazole 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:

hexadecanoic acid methyl ester (112-39-0) + 1,2-diamino-benzene (95-54-5) → 1-N-(palmitoyl)-amino-2-benzene + 2-pentadecyl-1H-benzo[d]imidazole (5805-26-5)

Guidance literature:

With lipase from Mucor miehei; at 50 ℃; for 60h; Enzymatic reaction;

DOI:10.1016/j.molcatb.2010.06.013

Reference yield:

hexadecanoic acid ethyl ester (628-97-7) + 1,2-diamino-benzene (95-54-5) → 1-N-(palmitoyl)-amino-2-benzene + 2-pentadecyl-1H-benzo[d]imidazole (5805-26-5)

Guidance literature:

With lipase from Mucor miehei; at 50 ℃; for 60h; Enzymatic reaction;

DOI:10.1016/j.molcatb.2010.06.013

Reference yield: 40.0%

2-pentadecyl-1H-benzo[d]imidazole (5805-26-5) + benzyl chloride (100-44-7) → 1,3-dibenzyl-2-pentadecyl-1H-benzimidazol-3-ium chloride + 1-benzyl-2-pentadecyl-1H-benzimidazole

Guidance literature:

With potassium carbonate; In tetrahydrofuran; for 60h; Reflux; Inert atmosphere;

DOI:10.1080/14756366.2017.1410480

upstream raw materials:

hexadecanoic acid methyl ester

1,2-diamino-benzene

hexadecanoic acid ethyl ester

Refernces