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1,4-Benzenediamine, N1,N1,N4,N4-tetraphenyl-
N1,N1,N4,N4-tetraphenylbenzene-1,4-diaMine · ,4-Bis(diphenylamino)benzene · 1,4-Bis(diphenylamino)benzene 97% · tetra-N-phenyl-para-phenylenediamine · N,N,N',N'-Tetraphenyl-1,4-benzenediamine · N,N,N',N'-tetraphenyl-p-phenylenediamine · N1,N1,N4,N4-Tetraphenyl-1,4-benzenediamine · N,N,N',N'-Tetraphenyl-1,4-phenylenediamine
Identifikatoren & physikalische Daten
| CAS No. | 14118-16-2 |
|---|---|
| Summenformel | C30H24N2 |
| Durchschnittliche Molmasse | 412,5 g/mol |
| Monoisotopische Masse | 412,19394877 g/mol |
| SMILES | c1ccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1 |
| InChIKey | JPDUPGAVXNALOL-UHFFFAOYSA-N |
| PubChem CID | 84207 |
| EC No. | 627-175-1 |
| DTXSID | DTXSID7065708 |
Chemische & physikalische Eigenschaften
| XLogP | 9 |
|---|---|
| Polarare Oberfläche (TPSA) | 6,5 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 6 |
| Schwere Atome | 32 |
| Formalladung | 0 |
| Komplexität | 431 |
| Schmelzpunkt | 201-205 °C |
| Siedepunkt | 571.2±33.0 °C(Predicted) |
| Dichte | 1.172±0.06 g/cm3(Predicted) |
| Lagerbedingungen | RT, protect from light |
| pKa (Säurekonstante) | -2.19±0.60(Predicted) |
| Aggregatzustand | powder to crystal |
| Farbe | White to Almost white |
| InChI | 1S/C30H24N2/c1-5-13-25(14-6-1)31(26-15-7-2-8-16-26)29-21-23-30(24-22-29)32(27-17-9-3-10-18-27)28-19-11-4-12-20-28/h1-24H |
| InChIKey | JPDUPGAVXNALOL-UHFFFAOYSA-N |
| SMILES | c1ccc(cc1)N(c2ccccc2)c3ccc(cc3)N(c4ccccc4)c5ccccc5 |
| EPA chemische Informationen | 1,4-Benzenediamine, N,N,N',N'-tetraphenyl- (14118-16-2) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, 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. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 2921.51.5000 |
| R-Sätze (R) | 22 |
| Gefahrensymbole | Xn |
| Lagerklasse | 13 - Non Combustible Solids |
| Gefahrenklasse | Acute Tox. 4 Oral |
Anwendungen & Verwendung
Verwenden
Used in OLED multilayers and molecular magnets