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2-Amino-4,5-diphenylthiazole
Bax 439 · NSC 31689 · 4,5-Diphenylthiazol-2-amine · 4,5-Diphenyl-2-aminothiazole · 2-Amino-4,5-diphenylthiazole · 4,5-di(phenyl)-2-thiazolamine · 2-ThiazolaMine, 4,5-diphenyl- · Thiazole, 2-amino-4,5-diphenyl-
Identifikatoren & physikalische Daten
| CAS No. | 6318-74-7 |
|---|---|
| Summenformel | C15H12N2S |
| Durchschnittliche Molmasse | 252,3 g/mol |
| Monoisotopische Masse | 252,07211938 g/mol |
| SMILES | Nc1nc(-c2ccccc2)c(-c2ccccc2)s1 |
| InChIKey | XDWGEGZDMFHZBL-UHFFFAOYSA-N |
| PubChem CID | 73222 |
| ChEMBL | CHEMBL247129 |
| EC No. | 678-909-2 |
| DTXSID | DTXSID70212532 |
Chemische & physikalische Eigenschaften
| XLogP | 3,9 |
|---|---|
| Polarare Oberfläche (TPSA) | 67,2 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 18 |
| Formalladung | 0 |
| Komplexität | 259 |
| Schmelzpunkt | 189-190℃ (hexane ethyl acetate ) |
| Siedepunkt | 420.0±14.0 °C(Predicted) |
| Dichte | 1.230±0.06 g/cm3(Predicted) |
| Lagerbedingungen | 2-8°C(protect from light) |
| pKa (Säurekonstante) | 4.02±0.10(Predicted) |
| Löslichkeit | Insoluble in water. Soluble in chloroform and methanol. |
| CAS Datenbank | 6318-74-7 |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 6 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
| Alarmwort | Warnung |
| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
Anwendungen & Verwendung
Verwenden
Bis(trimethylsilyl)acetylene is a ligand that binds to a central metal ion (e.g. Titanium) to create a coordination complex. One of its complexes, Permethyltitanocene-bis(trimethylsilyl)acetylene, is a catalyst for the head-to-tail dimerization of 1-alkynes (e.g. 3-Penten-1-yne).