HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Tetraphenylcyclopentadienon
TC · Cyclone · TETRACYCLONE · 2,3,4,5-Tetraphenylcyclopentadienone · Tetracyclon · opentadienone · Cyclone (compound) · RARECHEM AM UF S096
Identifikatoren & physikalische Daten
| CAS No. | 479-33-4 |
|---|---|
| Summenformel | C29H20O |
| Durchschnittliche Molmasse | 384,5 g/mol |
| Monoisotopische Masse | 384,15141526 g/mol |
| SMILES | O=C1C(c2ccccc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccccc1 |
| InChIKey | PLGPSDNOLCVGSS-UHFFFAOYSA-N |
| PubChem CID | 68068 |
| ChEMBL | CHEMBL4534655 |
| ChEBI | CHEBI:188913 |
| EC No. | 207-530-3 |
| DTXSID | DTXSID1060059 |
| Lokaler Name | Tetraphenylcyclopentadienon |
Chemische & physikalische Eigenschaften
| XLogP | 6,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 17,1 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 4 |
| Schwere Atome | 30 |
| Formalladung | 0 |
| Komplexität | 613 |
| SpringerMaterials Properties | 13C nuclear magnetic resonance spectrum |
| Endocrine Disruptors | Potential endocrine disrupting compound |
| Schmelzpunkt | 217-220 °C (lit.) |
| Siedepunkt | 471.14°C (rough estimate) |
| Dichte | 1.0511 (rough estimate) |
| Brechungsindex | 1.6020 (estimate) |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Aggregatzustand | Fine Crystalline Powder |
| Farbe | Black |
| Löslichkeit | Soluble in Benzene. Insoluble in water. |
| BRN | 683115 |
| Stabilität | Stable. Combustible. Light sensitive. |
| InChI | 1S/C29H20O/c30-29-27(23-17-9-3-10-18-23)25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22)28(29)24-19-11-4-12-20-24/h1-20H |
| InChIKey | PLGPSDNOLCVGSS-UHFFFAOYSA-N |
| SMILES | O=C1C(c2ccccc2)=C(c3ccccc3)C(c4ccccc4)=C1c5ccccc5 |
| CAS Datenbank | 479-33-4(CAS DataBase Reference) |
| NIST chemische Informationen | Tetraphenylcyclopentadienone(479-33-4) |
| EPA chemische Informationen | 2,4-Cyclopentadien-1-one, 2,3,4,5-tetraphenyl- (479-33-4) |
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)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Chemical: 2,4-Cyclopentadien-1-one, 2,3,4,5-tetraphenyl-2,4-Cyclopentadien-1-one, 2,3,4,5-tetraphenyl-: Does not have an individual approval but may be used under an appropriate group standard |
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 29143990 |
| Sicherheitshinweise (S) | 24/25-22 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
Tetraphenylcyclopentadienone is a building block for several organic and organometallic compounds. It is also used as an efficient cyclone system or in re-circulation systems for the capturing of fine active pharmaceuticals and food ingredients.