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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2394722Generated: October 29, 2026

Water → HCID 21960044, compound

https://huagongshe.com/reaction/2394722

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantPotassium HydroxideHCID 14797—
ReactantFumaric AcidHCID 444972—
Reactant(2,4-Difluorophenyl)[1-(phenylmethyl)-3-pyrrolidinyl]methanone oximeHCID 73856697—
SolventEthanolHCID 702—
ProductHCID 21960044HCID 2196004474.8%

Reaction Steps

A mixture of (2,4-difluorophenyl)[1-(phenylmethyl)-3-pyrrolidinyl]methanone oxime (10.8 g, 34.2 mmol), potassium hydroxide (10 g), water (100 ml), and ethanol (100 ml) was heated at reflux for 2 hours. At the end of the reaction, the solution was cooled and ethanol was removed on a rotary evaporator. The aqueous mixture was diluted with water (100 ml) then extracted with dichloromethane (500 ml). The organic solution was washed with brine and dried over anhydrous MgSO4. The solution was concentrated to an oil (9.8 g). The crude product was purified by flash chromatography over a silica gel column. The product thus obtained weighed 4.46 g (44%) as a light yellow oil. The oily product was dissolved in ethanol, and then treated with a solution of fumaric acid (1.73 g, 1.0 eq) in ethanol. Crystallization took place slowly with the addition of isopropyl ether. Recrystallization from ethanol (15 ml) gave 4.6 g of 6-fluoro-3-[1-(phenylmethyl)-3-pyrrolidinyl]-1,2-benzisoxazole fumarate as white crystals, m.p.=142°-144° C.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05811435
Source datasetuspto-grants-1998_09
ORD IDord-181d39cf3ea14ef39d15bb616960d6e5
Source noteuspto-grants-1998_09