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HRID 1407147作成日:2026年10月26日

Hydrochloric Acid → HCID 178496282、化合物

https://huagongshe.com/reaction/1407147

反応式

関与物質

役割名称HCID仕込み量
反応物Hydrochloric AcidHCID 313—
反応物Methyl 4-methoxyacetoacetateHCID 123500—
反応物Sodium AcetateHCID 517045—
反応物4-(Benzyloxy)-2-fluoroanilineHCID 11499809—
反応物Sodium NitriteHCID 23668193—
溶媒MethanolHCID 887—
溶媒WaterHCID 962—
生成物HCID 178496282HCID 17849628294.4%

反応条件

温度0 °C

反応手順

A solution of NaNO2 (2.07 g, 30 mmol) in H2O (5 mL) was added dropwise at 0° C. to a mixture of 4-(benzyloxy)-2-fluoroaniline (5.43 g, 25 mmol) and 6 M HCl aqueous solution (25 mL, 150 mmol). After stirring for 15 min, the resulting aqueous solution was added to a suspension of methyl 4-methoxyacetoacetate (3.24 mL, 24 mmol) and NaOAc (12.3 g, 150 mmol) in MeOH (50 mL) pre-cooled at 0° C. The reaction mixture was poured into water and extracted with AcOEt. The extract was washed with brine, dried over MgSO4, and concentrated under reduced pressure. The residue was recrystallized from hexane/AcOEt to give the title compound (8.48 g, 91% yield) as a yellow solid: 1H NMR (300 MHz, CDCl3): δ ppm 3.500 (3H×0.46, s), 3.502 (3H×0.54, s), 3.88 (3H×0.54, s), 3.92 (3H×0.46, s), 4.65 (2H×0.46, s), 4.68 (2H×0.54, s), 5.06 (2H×0.54, s), 5.07 (2H×0.46, s), 6.75-6.86 (2H, m), 7.32-7.44 (5H, m), 7.53 (1H×0.46, t, J=9.0 Hz), 7.76 (1H×0.54, t, J=9.0 Hz), 13.12 (1H×0.46, brs), 15.13 (1H×0.54, brs).

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US08916566B2
出典データセットuspto-grants-2014_12
ORD IDord-7c1c9473313346adb33f9288e57ef694
出典メモuspto-grants-2014_12