HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
6-Chlornicotinamid
6-chloroamide · oronicotinamide · 6-CHLORONICOTINAMIDE · 6-Chloronicotinamide,98% · 6-Chloronicotinamide >6-Chloronicotinamide, 95% · 6-Chloropyridin-3-carboxamide · 6-Chloro-3-pyridinecarboxamide · 2-CHLOROPYRIDINE-5-CARBOXAMIDE
Identifikatoren & physikalische Daten
| CAS No. | 6271-78-9 |
|---|---|
| Summenformel | C6H5ClN2O |
| Durchschnittliche Molmasse | 156,57 g/mol |
| Monoisotopische Masse | 156,00904046 g/mol |
| SMILES | NC(=O)c1ccc(Cl)nc1 |
| InChIKey | ZIJAZUBWHAZHPL-UHFFFAOYSA-N |
| PubChem CID | 80456 |
| EC No. | 228-456-8 |
| DTXSID | DTXSID60211796 |
| Lokaler Name | 6-Chlornicotinamid |
Chemische & physikalische Eigenschaften
| XLogP | 2 |
|---|---|
| Polarare Oberfläche (TPSA) | 56 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 140 |
| SpringerMaterials Properties | Nuclear quadrupole resonance spectroscopy |
| Schmelzpunkt | 210-212 °C (lit.) |
| Siedepunkt | 331.0±27.0 °C(Predicted) |
| Dichte | 1.381±0.06 g/cm3(Predicted) |
| Lagerbedingungen | under inert gas (nitrogen or Argon) at 2-8°C |
| pKa (Säurekonstante) | 14.54±0.50(Predicted) |
| Aggregatzustand | Crystalline Powder or Powder |
| Farbe | White to pale yellow |
| BRN | 116043 |
| InChI | 1S/C6H5ClN2O/c7-5-2-1-4(3-9-5)6(8)10/h1-3H,(H2,8,10) |
| InChIKey | ZIJAZUBWHAZHPL-UHFFFAOYSA-N |
| SMILES | NC(=O)c1ccc(Cl)nc1 |
| CAS Datenbank | 6271-78-9(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 46 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29333990 |
| R-Sätze (R) | 36/37/38-20/21/22 |
| Gefahrensymbole | Xi,Xn |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 26-37/39-36/37/39-22 |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
Anwendungen & Verwendung
Verwenden
6-Chloro-3-pyridinecarboxamide shows Moderate activity against the leukemia.