HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 318Erstellt: 23. Oktober 2026
Piperazine → 4-Fluoro-2-(piperazin-1-yl)benzonitrile
https://huagongshe.com/de/reaction/318
Beteiligte Stoffe
| Rolle | Name | HCID | Einwaage |
|---|
| Edukt | Piperazine | HCID 4837 | — |
| Edukt | 2-Bromo-4-fluorobenzonitrile | HCID 118939 | — |
| Reagenz | Cesium carbonate | HCID 10796 | — |
| Katalysator | Binap, (A+-)- | HCID 634876 | — |
| Katalysator | Bis(dibenzylideneacetone)palladium | HCID 9811564 | — |
| Lösungsmittel | 1,4-Dioxane | HCID 31275 | — |
| Produkt | 4-Fluoro-2-(piperazin-1-yl)benzonitrile | HCID 19367108 | 0% |
Reaktionsschritte
Tris(dibenzylideneacetone)dipalladium (0) (57.2 mg, 0.06 mmol) and rac-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl (78 mg, 0.12 mmol) were added to a mixture of 2-bromo-4-fluorobenzonitrile (250 mg, 1.25 mmol), Cesium carbonate (611 mg, 1.87 mmol) and Piperazine (215 mg, 2.50 mmol) in dioxane (3 mL). Reaction vessel was placed in an oil bath at 90 °C 4pm. LCMS o/n shows several peaks. Larger peak corresponding to displacement of F by piperazine (MW266) than for desired product (205). Discarded
Herkunft & Nachweise
| Quelldatensatz | 750 AstraZeneca ELN dataset |
|---|
| ORD ID | ord-91c1aa5c02fc46a586e9f5a373b7526a |
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| Quellennotiz | 750 AstraZeneca ELN dataset |
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