1-[(4-Nitrophenyl)methyl]-1H-benzimidazole

Base Information

Chemical Name:1-[(4-Nitrophenyl)methyl]-1H-benzimidazole
CAS No.:22550-27-2
Molecular Formula:C14H11N3O2
Molecular Weight:253.26
Hs Code.:
DSSTox Substance ID:DTXSID40548512
Nikkaji Number:J1.360.665J
Wikidata:Q82427239
Mol file:22550-27-2.mol

Synonyms:22550-27-2;1-[(4-Nitrophenyl)methyl]-1H-benzimidazole;SCHEMBL2023928;SCHEMBL12640621;DTXSID40548512

Suppliers and Price of 1-[(4-Nitrophenyl)methyl]-1H-benzimidazole

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of 1-[(4-Nitrophenyl)methyl]-1H-benzimidazole

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:253.085126602
Heavy Atom Count:19
Complexity:323

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C2C(=C1)N=CN2CC3=CC=C(C=C3)[N+](=O)[O-]

Technology Process of 1-[(4-Nitrophenyl)methyl]-1H-benzimidazole

There total 4 articles about 1-[(4-Nitrophenyl)methyl]-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: 93.0%

: 51-17-2,79351-71-6
benzoimidazole

: 100-14-1
4-nitrobenzyl chloride

: 22550-27-2
1-(4-nitrobenzyl)-1H-benzimidazole

Guidance literature:: With potassium carbonate; In acetonitrile; for 58h; Irradiation;
DOI:10.1016/S0040-4039(00)85434-9

Reference yield: 90.0%

: 51-17-2,79351-71-6
benzoimidazole

: 100-11-8
1-bromomethyl-4-nitro-benzene

: 22550-27-2
1-(4-nitrobenzyl)-1H-benzimidazole

Guidance literature:: benzoimidazole; With caesium carbonate; In methanol; at 5 - 20 ℃; for 0.166667h;

1-bromomethyl-4-nitro-benzene; In methanol; at 5 - 20 ℃; for 0.25h;
DOI:10.1039/c7nj01876b

Reference yield:

: 706785-08-2
4,5-diethynyl-1-(4-nitro-benzyl)-1H-imidazole

: 22550-27-2
1-(4-nitrobenzyl)-1H-benzimidazole

Guidance literature:: With cyclohexa-1,4-diene; In benzene-d6; at 125 ℃; Further Variations:; Temperatures; Kinetics;
DOI:10.1016/j.tetlet.2004.02.152