HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
4-Aminoquinoline
Quinolin-4-amine · 4-AMINOQUINOLINE · 4-Quinolylamine · 4-QUINOLINAMINE · 4-Aminoguinoline · QUINOLIN-4-YLAMINE · 4(1H)-Quinolinimine · 4-Aminoquinoline 95+%
Identifikatoren & physikalische Daten
| CAS No. | 578-68-7 |
|---|---|
| Summenformel | C9H8N2 |
| Durchschnittliche Molmasse | 144,17 g/mol |
| Monoisotopische Masse | 144,06874826 g/mol |
| SMILES | Nc1ccnc2ccccc12 |
| InChIKey | FQYRLEXKXQRZDH-UHFFFAOYSA-N |
| PubChem CID | 68476 |
| ChEMBL | CHEMBL58146 |
| EC No. | 640-116-4 |
| DTXSID | DTXSID70206491 |
Chemische & physikalische Eigenschaften
| XLogP | 1,6 |
|---|---|
| Polarare Oberfläche (TPSA) | 38,9 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 11 |
| Formalladung | 0 |
| Komplexität | 136 |
| Schmelzpunkt | 151.0 and le 155.0 °C |
| Siedepunkt | 312.78°C (estimate) |
| Dichte | 1.1148 (estimate) |
| Brechungsindex | 1.7080 (estimate) |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| Aggregatzustand | powder to crystalline |
| pKa (Säurekonstante) | 9.17(at 20℃) |
| Farbe | White to Yellow to Orange |
| InChI | InChI=1S/C9H8N2/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-6H,(H2,10,11) |
| InChIKey | FQYRLEXKXQRZDH-UHFFFAOYSA-N |
| SMILES | N1C2C(=CC=CC=2)C(N)=CC=1 |
| CAS Datenbank | 578-68-7(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (93%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (11.6%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 43 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (93%)Skin Irrit. 2 (11.6%)Eye Irrit. 2A (100%) |
| Wassergefährdungsklasse (WGK) | WGK 3 |
| UN-Transportnummer | 2811 |
| Zollcode | 29334900 |
| R-Sätze (R) | 20/21/22-36/37/38-36-22-41 |
| Gefahrensymbole | Xn |
| Sicherheitshinweise (S) | 26-36/37/39-39 |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Acute Tox. 4 OralEye Irrit. 2 |
Anwendungen & Verwendung
Verwenden
4-Quinolinamine and its derivatives are commonly used as anti-malarial drugs and also have potential therapeutic effects on patients afflicted with arthritis (and/or related diseases).