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HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 2370953Erstellt: 25. Oktober 2026

Trimethyl orthoformate → 1-(2-cyclopropyl-3-fluoro-5-nitrophenyl)-1H-tetrazole

https://huagongshe.com/reaction/2370953

Reaktionsgleichung

Beteiligte Stoffe

RolleNameHCIDEinwaage
EduktTrimethyl orthoformateHCID 9005—
EduktSodium HydroxideHCID 14798—
EduktAzidotrimethylsilaneHCID 78378—
Edukt2-Cyclopropyl-3-fluoro-5-nitroanilineHCID 58065799—
LösungsmittelAcetic AcidHCID 176—
LösungsmittelEthyl AcetateHCID 8857—
Produkt1-(2-cyclopropyl-3-fluoro-5-nitrophenyl)-1H-tetrazoleHCID 5806578890%

Reaktionsbedingungen

Temperatur70 °C

Reaktionsschritte

A mixture of 2-cyclopropyl-3-fluoro-5-nitroaniline (300 mg, 1.53 mmol, 1 equiv), trimethylsilyl azide (1.0 mL, 7.65 mmol, 5 equiv), trimethylorthoformate (1.67 mL, 15.29 mmol, 10 equiv) in AcOH (3 mL) was heated to 70° C. and stirred for 7 hours behind a blast shield. After allowing to cool to room temperature, the mixture was further cooled in ice-water and basified to ca. pH 12-14 with 1N NaOH and diluted with EtOAc. The aqueous and organic layers were partitioned and the aqueous extracted with EtOAc (2×150 mL). The combined organic extracts were washed with 1N NaOH (1×100 mL), dried (Na2SO4), filtered, and the solvent removed under vacuum—silica gel was added at this stage so that the crude product was absorbed directly on to silica gel. The crude product was purified by column chromatography on silica gel using EtOAc/hexanes (30-50% EtOAc in increments of 10% EtOAc) to give the product 1-(2-cyclopropyl-3-fluoro-5-nitrophenyl)-1H-tetrazole (343 mg, 90%) as a white solid.

Herkunft & Nachweise

DOI10.6084/m9.figshare.5104873.v1
PatentnummerUS08710223B2
Quelldatensatzuspto-grants-2014_04
ORD IDord-94242536a4be4e3396df01528947aefb
Quellennotizuspto-grants-2014_04