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HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 468548Erstellt: 25. Oktober 2026

Sodium Chloride → 3-Ethoxybenzo[D]isoxazol-6-OL

https://huagongshe.com/reaction/468548

Reaktionsgleichung

Beteiligte Stoffe

RolleNameHCIDEinwaage
EduktSodium ChlorideHCID 5234—
EduktBoron tribromideHCID 25134—
Edukt1,2-BenzisoxazoleHCID 71073—
EduktSodium BicarbonateHCID 516892—
Edukt3-Ethoxy-6-methoxybenzo[D]isoxazoleHCID 21077805—
LösungsmittelWaterHCID 962—
LösungsmittelDichloromethaneHCID 6344—
LösungsmittelEthyl acetate hexaneHCID 21226206—
Produkt3-Ethoxybenzo[D]isoxazol-6-OLHCID 135848745—

Reaktionsschritte

Boron tribromide (1.0M solution in dichloromethane; 1.39 ml, 1.39 mmol) was added to a stirred, −78° cooled solution of benzisoxazole from part (c) (179 mg, 928 μmol) in dichloromethane (4 ml) under an argon atmosphere. The reaction mixture was gradually warmed to room temperature over approx. 2 hours, and stirred overnight. Tlc (silica, 2:1 hexane/ethyl acetate) showed new polar material as well as unreacted starting material. The reaction was worked up by adding water (5 ml) and ice. The aqueous phase was neutralized by addition of saturated NaHCO3 solution, and saturated with NaCl. The aqueous phase was extracted into dichloromethane (3×60 ml), then the organic extracts combined and washed with brine (10 ml) and dried (NaSO4). The product was purified by chromatography on silica (18 g; eluent 2.5%, 5%, then 15% ethyl acetate/hexane). The first compound to elute was unreacted 3-ethoxy-6-methoxy-1,2-benzisoxazole, (46 mg), followed by 3-ethoxy-6-hydroxy-1,2-benzisoxazole 108 mg (65%).

Herkunft & Nachweise

DOI10.6084/m9.figshare.5104873.v1
PatentnummerUS08624025B2
Quelldatensatzuspto-grants-2014_01
ORD IDord-e14487a2cb074265b850a55d99405b4a
Quellennotizuspto-grants-2014_01