2-(4-Benzylpiperazin-1-yl)-5-trifluoromethylpyrimidine

Base Information

• Chemical Name: 2-(4-Benzylpiperazin-1-yl)-5-trifluoromethylpyrimidine
• CAS No.: 845616-57-1
• Molecular Formula: C16H17F3N4
• Molecular Weight: 322.333
• Mol file: 845616-57-1.mol

Synonyms:

Chemical Property of 2-(4-Benzylpiperazin-1-yl)-5-trifluoromethylpyrimidine

Chemical Property:

• Boiling Point: 418.7±55.0 °C(Predicted)
• PKA: 7.03±0.10(Predicted)
• PSA: 32.26000
• Density: 1.284±0.06 g/cm3(Predicted)
• LogP: 2.82050

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 2-(4-Benzylpiperazin-1-yl)-5-trifluoromethylpyrimidine

There total 2 articles about 2-(4-Benzylpiperazin-1-yl)-5-trifluoromethylpyrimidine 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: 94.0%

4-benzyl-piperazine-1-carboxamidine hydrochloride (7773-69-5) + (Z)-N-(3-(dimethylamino)-2-(trifluoromethyl)allylidene)-N-methylmethanaminium chloride salt → 2-(4-benzyl-piperazin-1-yl)-5-trifluoromethyl-pyrimidine (845616-57-1)

Guidance literature:

With triethylamine; In acetonitrile; at 20 ℃; for 3h;

DOI:10.1021/jm100210p

Reference yield:

4-benzyl-piperazine-1-carboxamidine hydrochloride (7773-69-5) + N-[3-(dimethylamino)-2-(trifluoromethyl)-2-propenylidene]-N-dimethylammonium chloride (176214-18-9) → 2-(4-benzyl-piperazin-1-yl)-5-trifluoromethyl-pyrimidine (845616-57-1)

Guidance literature:

With triethylamine; In acetonitrile; at 20 ℃; for 3h;

upstream raw materials:

4-benzyl-piperazine-1-carboxamidine hydrochloride

N-[3-(dimethylamino)-2-(trifluoromethyl)-2-propenylidene]-N-dimethylammonium chloride

Refernces

• 1、 -. "Sulfanyl substituted phenyl methanones". Page/Page column 7. . Retrieved 2008/06/13.
• 2、 -. "1- (2-AMINO-BENZOL) -PIPERAZINE DERIVATIVES AS GLYCINE UPTAKE INHIBITORS FOR THE TREATMENT OF PSYCHOSES". Page/Page column 148. . Retrieved 2008/06/13.