HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Pyrazolo(1,5-a)pyrimidine
pyrazolo[2,3-a]pyrimidine · Pyrazolo[1,5-a]pyrimidine · Pyrazolo[1,5-a]pyrimidine (8CI, 9CI, ACI)
Identifikatoren & physikalische Daten
| CAS No. | 274-71-5 |
|---|---|
| Summenformel | C6H5N3 |
| Durchschnittliche Molmasse | 119,12 g/mol |
| Monoisotopische Masse | 119,04834716 g/mol |
| SMILES | c1cnc2ccnn2c1 |
| InChIKey | LDIJKUBTLZTFRG-UHFFFAOYSA-N |
| PubChem CID | 11636795 |
| ChEMBL | CHEMBL2036808 |
| EC No. | 800-903-7 |
| DTXSID | DTXSID70469781 |
Chemische & physikalische Eigenschaften
| XLogP | 0,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 30,2 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 9 |
| Formalladung | 0 |
| Komplexität | 104 |
| Schmelzpunkt | 105 °C |
| Dichte | 1.29±0.1 g/cm3(Predicted) |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| pKa (Säurekonstante) | 0.33±0.30(Predicted) |
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)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
| Zollcode | 29335990 |
| R-Sätze (R) | 20/21/22 |
| Sicherheitshinweise (S) | 36/37 |
Anwendungen & Verwendung
Verwenden
Pyrazolo[1,5-a]pyrimidine is being researched as a protein kinase CK2 inhibitors.