HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
6-Fluor-2-methylchinolin
6-FLUORO-2-METHYLQUINOLINE · AKOS 1002 · 6-FLUOROQUINALDINE · 6-Fluoroquildine, 98% · 2-METHYL-6-FLUOROQUINOLINE · 6-flouro-2-methyl quinoline · Quinoline, 6-fluoro-2-methyl- · 6-Fluoro-2-methylquinoline>6-Fluoro-2-methylquinoline97%
Identifikatoren & physikalische Daten
| CAS No. | 1128-61-6 |
|---|---|
| Summenformel | C10H8FN |
| Durchschnittliche Molmasse | 161,18 g/mol |
| Monoisotopische Masse | 161,06407748 g/mol |
| SMILES | Cc1ccc2cc(F)ccc2n1 |
| InChIKey | GPIARMSVZOEZCV-UHFFFAOYSA-N |
| PubChem CID | 70784 |
| EC No. | 214-439-2 |
| DTXSID | DTXSID50150180 |
| Lokaler Name | 6-Fluor-2-methylchinolin |
Chemische & physikalische Eigenschaften
| XLogP | 2,7 |
|---|---|
| Polarare Oberfläche (TPSA) | 12,9 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 12 |
| Formalladung | 0 |
| Komplexität | 160 |
| Schmelzpunkt | 49-53 °C (lit.) |
| Siedepunkt | 99 °C / 3mmHg |
| Dichte | 1.1465 (estimate) |
| Flammpunkt | >230 °F |
| Lagerbedingungen | Inert atmosphere,Room Temperature |
| Löslichkeit | Soluble in Chloroform. |
| pKa (Säurekonstante) | 5.16±0.43(Predicted) |
| Aggregatzustand | powder to crystal |
| Farbe | White to Almost white |
| BRN | 1281677 |
| InChI | 1S/C10H8FN/c1-7-2-3-8-6-9(11)4-5-10(8)12-7/h2-6H,1H3 |
| InChIKey | GPIARMSVZOEZCV-UHFFFAOYSA-N |
| SMILES | Cc1ccc2cc(F)ccc2n1 |
| CAS Datenbank | 1128-61-6(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, 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 47 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 | 29334990 |
| R-Sätze (R) | 38-41-36/37/38 |
| Gefahrensymbole | Xi |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 26-37/39-36 |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Eye Dam. 1Skin Irrit. 2 |
Anwendungen & Verwendung
Verwenden
Quinoline derivative as a highly potent thrombin receptor antagonist