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HRID 397518Erstellt: 24. Oktober 2026
1H-1,2,4-Triazole → 5-Chloro-2-(1H-1,2,4-triazol-1-YL)benzonitrile
https://huagongshe.com/de/reaction/397518
Beteiligte Stoffe
| Rolle | Name | HCID | Einwaage |
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| Edukt | 1H-1,2,4-Triazole | HCID 9257 | — |
| Edukt | Cesium carbonate | HCID 10796 | — |
| Edukt | 2,5-Dichlorobenzonitrile | HCID 89000 | — |
| Lösungsmittel | Water | HCID 962 | — |
| Lösungsmittel | Dimethylformamide | HCID 6228 | — |
| Produkt | 5-Chloro-2-(1H-1,2,4-triazol-1-YL)benzonitrile | HCID 21866296 | — |
Reaktionsschritte
To a solution of 2,5-dichlorobenzonitrile (10 g, 58.1 mmol) in DMF (100 ml) is added cesium carbonate (22.7 g, 69.8 mmol) and 1,2,4-triazole (4.8 g, 69.8 mmol) and the reaction mixture is stirred at 65° C. for 5.5 h, at 75° C. for 16 h, at 85° C. for 7 h. More 1,2,4-triazole (5 g) is added and the reaction mixture is stirred at 85° C. for 18 h and at 100° C. for 4 h. After cooling to room temperature, the mixture is diluted with water and extracted with EtOAc 3 times. The combined organic layer is washed with aqueous LiCl, dried on sodium sulfate, concentrated in vacuo to give 5-Chloro-2-[1,2,4]triazol-1-yl-benzonitrile as a white solid which is used in the next step without further purification.
Herkunft & Nachweise
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patentnummer | US06610701B2 |
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| Quelldatensatz | uspto-grants-2003_08 |
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| ORD ID | ord-4eec846f019147878c9190737f6e39cb |
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| Quellennotiz | uspto-grants-2003_08 |
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