HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 8024280Erstellt: 2. November 2026
1-benzyl-4-chloro-6-(trifluoromethyl)-1H-pyrazolo(3,4-d)pyrimidine
https://huagongshe.com/de/chemical/8024280
Identifikatoren & physikalische Daten
| CAS No. | 871547-71-6 |
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| Summenformel | C13H8ClF3N4 |
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| Durchschnittliche Molmasse | 312,68 g/mol |
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| Monoisotopische Masse | 312,0389585 g/mol |
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| SMILES | FC(F)(F)c1nc(Cl)c2cnn(Cc3ccccc3)c2n1 |
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| InChIKey | IITCFKGWYDMNCC-UHFFFAOYSA-N |
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| PubChem CID | 8024280 |
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| EC No. | 984-134-3 |
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Chemische & physikalische Eigenschaften
| XLogP | 3,7 |
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| Polarare Oberfläche (TPSA) | 43,6 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 6 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 21 |
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| Formalladung | 0 |
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| Komplexität | 362 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Acute Tox. 4 (100%) |
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