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4-Chlor-8-(trifluormethyl)chinolin
BUTTPARK 14\09-64 · 4-CHLORO-8-(TRIFLUOROMETHYL)QUINOLINE · 4-Chloro-8-(trifluoroMethyl)quinolline · Quinoline, 4-chloro-8-(trifluoromethyl)- · 4-Chloro-8-(trifluoromethyl)quinoline98% · 4-Chloro-8-(trifluoromethyl)quinoline 98% · 4-CHLORO-8-(TRIFLUOROMETHYL)QUINOLINE, 9 7% · 4-CHLORO-8-(TRIFLUOROMETHYL)QUINOLINE ISO 9001：2015 REACH
Identifikatoren & physikalische Daten
| CAS No. | 23779-97-7 |
|---|---|
| Summenformel | C10H5ClF3N |
| Durchschnittliche Molmasse | 231,6 g/mol |
| Monoisotopische Masse | 231,0062615 g/mol |
| SMILES | FC(F)(F)c1cccc2c(Cl)ccnc12 |
| InChIKey | LINGICLAECZKAW-UHFFFAOYSA-N |
| PubChem CID | 90262 |
| EC No. | 245-880-9 |
| DTXSID | DTXSID70178467 |
| Lokaler Name | 4-Chlor-8-(trifluormethyl)chinolin |
Chemische & physikalische Eigenschaften
| XLogP | 3,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 12,9 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 4 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 15 |
| Formalladung | 0 |
| Komplexität | 231 |
| Schmelzpunkt | 80-82 °C(lit.) |
| Siedepunkt | 265.5±35.0 °C(Predicted) |
| Dichte | 1.427±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Inert atmosphere,Room Temperature |
| Löslichkeit | Chloroform, MethanolLow solubility in water. |
| Aggregatzustand | Solid |
| pKa (Säurekonstante) | 1.30±0.30(Predicted) |
| Farbe | Brown |
| CAS Datenbank | 23779-97-7(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 45 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 | 29334900 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26-36 |
| Gefahrenklasse | IRRITANT |
Anwendungen & Verwendung
Verwenden
4-Chloro-8-(trifluoromethyl)quinoline is used as a reagent for the potent CRTh2 (DP2) receptor antagonists discovery which is used for treatment of asthma, allergic rhinitis and other inflammatory diseases.