Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1900376Generated: October 29, 2026

Acetonitrile → HCID 10025444, compound

https://huagongshe.com/reaction/1900376

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetonitrileHCID 6342—
ReactantPotassium CarbonateHCID 11430—
Reactant3-(4-Piperidyl)-6-fluoro-1,2-benzisoxazoleHCID 849421—
Reactant1-[4-(3-Chloropropoxy)-3-methylaminophenyl]ethanoneHCID 10331942—
SolventWaterHCID 962—
SolventDichloromethane methanolHCID 21226129—
ProductHCID 10025444HCID 1002544447.9%

Reaction Steps

A mixture of 6-fluoro-3-(4-piperidinyl)-1,2-benzisoxazole (2.3 g, 10.3 mmol), K2CO3 (1.4 g, 10.3 mmol), 1-[4-(3-chloropropoxy)-3-(methylamino)phenyl]ethanone (2.5 g, 10.3 mmol), KI (0.10 g), and acetonitrile (100 ml) was stirred at reflux under nitrogen for 23 hours. The reaction was cooled to ambient temperature, poured into water, and the aqueous mixture was extracted with ethyl acetate. The ethyl acetate extract was washed twice with water, dried with MgSO4 and was concentrated to yield 4.8 g of a damp, brown solid. The compound was isolated by preparative HPLC (Waters Associates prep LC/System 500, utilizing 2 silica gel columns and 4% methanol-methylene chloride as eluent). Concentration of appropriate fractions afforded 2.4 g. Recrystallization from ethanol gave 2.1 g of 1-[4-[3-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]propoxy]-3-(methylamino)phenyl]ethanone as a beige solid, m.p.=151°-153° C.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05574032
Source datasetuspto-grants-1996_11
ORD IDord-758de2d87be54872baf748fbc787dbd7
Source noteuspto-grants-1996_11