戻る
化工社化工社 化学情報印刷レポート · 研究参考用
HRID 55652作成日:2026年10月23日

Ethyl Acetate → 4-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]2-methyl-2-hydroxybutane fumarate

https://huagongshe.com/ja/reaction/55652

反応式

関与物質

役割名称HCID仕込み量
反応物Ethyl AcetateHCID 8857—
反応物Ammonium ChlorideHCID 25517—
反応物Ethyl 3-[4-(6-fluoro-1,2-benzisoxazol-3-yl)1-piperidinyl]propionateHCID 21959991—
反応物HCID 178418573HCID 178418573—
溶媒TetrahydrofuranHCID 8028—
生成物4-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]2-methyl-2-hydroxybutane fumarateHCID 21960102—

反応手順

To a solution of ethyl 3-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]propionate (3.21 g, 10 mmol) in tetrahydrofuran (THF, 100 ml), was added methylmagnesium bromide (10 ml, 30 mmol, 3M solution in ether) dropwise over 15 minutes at room temperature under N2. The resulting mixture was stirred for 16 hours. The mixture was slowly hydrolyzed with aqueous NH4Cl solution. The THF solution was diluted with EtOAc (300 ml), then was washed with water and brine. The organic solution was separated and dried over MgSO4. After removal of solvent, the crude product was purified by flash chromatography (25 g, SiO2 ; eluted with 1 CH3OH:99 DCM). The material thus purified weighed 2.36 g (77%) as white crystals. This was converted to the fumarate salt by treatment with fumaric acid (895 mg) in ethanol. Recrystallization from ethanol yielded white crystals, 2.47 g, m.p.=156°-158° C.

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US05624927
出典データセットuspto-grants-1997_04
ORD IDord-983c8a9b5973494ab70f7bb78687e1b0
出典メモuspto-grants-1997_04