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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1482610Generated: October 30, 2026

1-(3-(Trifluoromethyl)phenyl)piperazine → 6-cyano-1-(4-(4-(3-trifluoromethylphenyl)piperazine-1-yl)butyl)-1H-benzotriazole

https://huagongshe.com/reaction/1482610

Reaction equation

Participants

RoleNameHCIDCharge
Reactant1-(3-(Trifluoromethyl)phenyl)piperazineHCID 4296—
ReactantPotassium IodideHCID 4875—
ReactantDiisopropylethylamineHCID 81531—
Reactant6-cyano-1-(4-chlorobutyl)-1H-benzotriazoleHCID 118386861—
SolventAcetonitrileHCID 6342—
Product6-cyano-1-(4-(4-(3-trifluoromethylphenyl)piperazine-1-yl)butyl)-1H-benzotriazoleHCID 7628388866.4%

Reaction Steps

6-cyano-1-(4-chlorobutyl)-1H-benzotriazole (8.42 g, 0.036 mol) was dissolved into 100 ml of acetonitrile, 3-trifluoro methylphenylpiperazine (6.9 g, 0.03 mol), diisopropylethylamine (15.5 g, 0.12 mol) and potassium iodide (5.0 g, 0.03 mol) were respectively added. The mixture was stirred and mixed, then heated and refluxed to react for 15 hours. The mixture was cooled down to ambient temperature and filtered. The filtrate was concentrated to produce oily products, and treated by chromatography with neutral Al2O3 and purified, eluted with dichloromethane to produce 8.5 g compound (I-55) with a yield of 66.4%. ESI-MS [M+H]+: m/z 428.2.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09415047B2
Source datasetuspto-grants-2016_08
ORD IDord-4f4fe3ae2cda4c5eb700d266a6b9f261
Source noteuspto-grants-2016_08