Benzenamine, N-methyl-2-nitro-4-[[2-[5-(trifluoromethyl)-1H-imidazol-2-yl]-4-pyridinyl]oxy]-

Base Information

• Chemical Name: Benzenamine, N-methyl-2-nitro-4-[[2-[5-(trifluoromethyl)-1H-imidazol-2-yl]-4-pyridinyl]oxy]-
• CAS No.: 927880-88-4
• Molecular Formula: C16H12 F3 N5 O3
• Molecular Weight: 379.298
• Mol file: 927880-88-4.mol

Synonyms:Benzenamine, N-methyl-2-nitro-4-[[2-[5-(trifluoromethyl)-1H-imidazol-2-yl]-4-pyridinyl]oxy]-

Chemical Property of Benzenamine, N-methyl-2-nitro-4-[[2-[5-(trifluoromethyl)-1H-imidazol-2-yl]-4-pyridinyl]oxy]-

Chemical Property:

• PSA: 108.65000
• LogP: 4.82890

Purity/Quality:

98% ^*data from raw suppliers

Benzenamine,N-methyl-2-nitro-4-[[2-[5-(trifluoromethyl)-1H-imidazol-2-yl]-4-pyridinyl]oxy]- 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Benzenamine, N-methyl-2-nitro-4-[[2-[5-(trifluoromethyl)-1H-imidazol-2-yl]-4-pyridinyl]oxy]-

There total 7 articles about Benzenamine, N-methyl-2-nitro-4-[[2-[5-(trifluoromethyl)-1H-imidazol-2-yl]-4-pyridinyl]oxy]- 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%

4-(4-Methylamino-3-nitro-phenoxy)-pyridine-2-carbaldehyde (611226-25-6) + 1,1-dibromo-3,3,3-trifluoroacetone (431-67-4) → N-methyl-2-nitro-4-((2-(5-(trifluoromethyl)-1H-imidazol-2-yl)pyridin-4-yl)oxy)aniline (927880-88-4)

Guidance literature:

1,1-dibromo-3,3,3-trifluoroacetone; With sodium acetate; In water; at 100 ℃; for 0.666667h;

4-(4-Methylamino-3-nitro-phenoxy)-pyridine-2-carbaldehyde; With ammonium hydroxide; In methanol; water; at 20 ℃;

DOI:10.1021/ml500526p

Reference yield: 41.0%

3-bromo-1,1,1-trifluoroacetone (431-35-6) → N-methyl-2-nitro-4-((2-(5-(trifluoromethyl)-1H-imidazol-2-yl)pyridin-4-yl)oxy)aniline (927880-88-4)

Guidance literature:

4-(4-Methylamino-3-nitro-phenoxy)-pyridine-2-carbonitrile; With sodium methylate; In isopropyl alcohol; at 50 ℃; for 1h;

3-bromo-1,1,1-trifluoroacetone; With ammonium acetate; In isopropyl alcohol; at 70 - 85 ℃; for 21h; Product distribution / selectivity;

Reference yield:

4-(4-Methylamino-3-nitro-phenoxy)-pyridine-2-carbaldehyde (611226-25-6) + C3BrF3O2 (1002333-90-5) → N-methyl-2-nitro-4-((2-(5-(trifluoromethyl)-1H-imidazol-2-yl)pyridin-4-yl)oxy)aniline (927880-88-4)

Guidance literature:

With ammonia; In methanol; water; at 20 ℃;

upstream raw materials:

4-(4-Methylamino-3-nitro-phenoxy)-pyridine-2-carbaldehyde

C₃BrF₃O₂

3-bromo-1,1,1-trifluoroacetone

2,2,2-Trifluoroacetaldehyde

Downstream raw materials:

CHIR-265

N₁-methyl-4-((2-(5-(trifluoromethyl)-1H-imidazol-2-yl)pyridin-4-yl)oxy)benzene-1,2-diamine

Refernces

• 1、 -. "FORMULATIONS FOR BENZIMIDAZOLYL PYRIDYL ETHERS". Page/Page column 28. . Retrieved 2008/06/13.
• 2、 -. "SOLID FORMS OF A RAF KINASE INHIBITOR". Page/Page column 58-59. . Retrieved 2009/01/20.