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2,5-Di(1-naphthyl)-1,3,4-oxadiazol
2,5-Di(1-naphtyl)-1,3,4-oxadiazole · 2,5-Bis(1-naphtyl)-1,3,4-oxadiazole · 2,5-DI(1-NAPHTHYL)-1,3,4-OXADIAZOLE · 2,5-Bis(1-naphthyl)-1,3,4-oxadiazole · 2,5-Di(1-naphthyl)-1,3,4-oxadiazole>1,3,4-Oxadiazole, 2,5-di-1-naphthalenyl- · 2,5-Di(naphthalen-1-yl)-1,3,4-oxadiazole
Identifikatoren & physikalische Daten
| CAS No. | 905-62-4 |
|---|---|
| Summenformel | C22H14N2O |
| Durchschnittliche Molmasse | 322,4 g/mol |
| Monoisotopische Masse | 322,11061307 g/mol |
| SMILES | c1ccc2c(-c3nnc(-c4cccc5ccccc45)o3)cccc2c1 |
| InChIKey | MUNFOTHAFHGRIM-UHFFFAOYSA-N |
| PubChem CID | 70182 |
| EC No. | 212-995-0 |
| DTXSID | DTXSID80238182 |
| Lokaler Name | 2,5-Di(1-naphthyl)-1,3,4-oxadiazol |
Chemische & physikalische Eigenschaften
| XLogP | 5,6 |
|---|---|
| Polarare Oberfläche (TPSA) | 38,9 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 25 |
| Formalladung | 0 |
| Komplexität | 415 |
| SpringerMaterials Properties | Angular frequency |
| Schmelzpunkt | 175-178°C |
| Siedepunkt | 556.4±33.0 °C(Predicted) |
| Dichte | 1.251±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Aggregatzustand | powder to crystal |
| pKa (Säurekonstante) | -5.16±0.50(Predicted) |
| Farbe | Light yellow to Brown |
| BRN | 285250 |
| InChI | 1S/C22H14N2O/c1-3-11-17-15(7-1)9-5-13-19(17)21-23-24-22(25-21)20-14-6-10-16-8-2-4-12-18(16)20/h1-14H |
| InChIKey | MUNFOTHAFHGRIM-UHFFFAOYSA-N |
| SMILES | c1ccc2c(cccc2c1)-c3nnc(o3)-c4cccc5ccccc45 |
| CAS Datenbank | 905-62-4(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P273, P301+P317, P330, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 2934.99.4400 |
| R-Sätze (R) | 22 |
| Gefahrensymbole | Xn |
| Sicherheitshinweise (S) | 22-24/25 |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Acute Tox. 4 OralAquatic Chronic 4 |
Anwendungen & Verwendung
Verwenden
Organic electronic material useful as an electron transporter in organic light emitting diodes (OLEDs).