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2,2'-Bichinolyl
2,2-BIQUINOLINE · CUPROIN · CUPROINE · CUPROIN R. G. · 2,2'-Quinolyl · 2,2'-BiquinoL · A,A -DIQUINOLYL · 2,2'-DIQUINOLYL
Identifikatoren & physikalische Daten
| CAS No. | 119-91-5 |
|---|---|
| Summenformel | C18H12N2 |
| Durchschnittliche Molmasse | 256,3 g/mol |
| Monoisotopische Masse | 256,10004838 g/mol |
| SMILES | c1ccc2nc(-c3ccc4ccccc4n3)ccc2c1 |
| InChIKey | WPTCSQBWLUUYDV-UHFFFAOYSA-N |
| PubChem CID | 8412 |
| EC No. | 204-357-5 |
| DTXSID | DTXSID8059500 |
| Lokaler Name | 2,2'-Bichinolyl |
Chemische & physikalische Eigenschaften
| XLogP | 4,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 25,8 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 20 |
| Formalladung | 0 |
| Komplexität | 297 |
| Stoffklassen | Nitrogen Compounds -> Quinolines |
| SpringerMaterials Properties | Boiling point |
| LogP (Verteilungskoeffizient) | 4.31 |
| Dampfdruck | 0.00000002 [mmHg] |
| Physical Description | Light yellow powder[Aldrich MSDS] |
| Schmelzpunkt | 192-195 °C(lit.) |
| Siedepunkt | 389.54°C (rough estimate) |
| Dichte | 0.9734 (rough estimate) |
| Brechungsindex | 1.6300 (estimate) |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| Löslichkeit | 1.02mg/lSparingly soluble in water (0.001g/L). |
| Aggregatzustand | Shiny Flakes |
| pKa (Säurekonstante) | 2.19±0.61(Predicted) |
| Farbe | Slightly yellow to light beige |
| BRN | 187259 |
| InChI | 1S/C18H12N2/c1-3-7-15-13(5-1)9-11-17(19-15)18-12-10-14-6-2-4-8-16(14)20-18/h1-12H |
| InChIKey | WPTCSQBWLUUYDV-UHFFFAOYSA-N |
| SMILES | c1ccc2nc(ccc2c1)-c3ccc4ccccc4n3 |
| CAS Datenbank | 119-91-5(CAS DataBase Reference) |
| NIST chemische Informationen | 2,2'-Biquinoline(119-91-5) |
| EPA chemische Informationen | 2,2'-Biquinoline (119-91-5) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 6% (3 of 50) of reports.WarningH315 (94%): 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 50 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: 2,2'-Biquinoline2,2'-Biquinoline: Does not have an individual approval but may be used under an appropriate group standard |
| Gefahrenübersicht | An irritant[Aldrich MSDS] See Quinoline. |
| Hazard Classes and Categories | Skin Irrit. 2 (94%) |
| F | 8 |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 29334990 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26-36-37/39 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
2,2'-Biquinoline is used as a reagent for spectrophotometric determination of Cu and as an indicator for titration of organolithium reagents, giving yellow-green charge-transfer complexes.