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4-Fluorbenzophenon
(4-FLUOROPHENYL)(PHENYL)METHANONE · C13H9FO · uorobenzophenone · RARECHEM AM UC 0605 · P-FLUOROBENZOPHENONE · 4-Fluoro-Benzophenon · 4-FLUOROBENZOPHENONE · 4'-Fluorobenzophenone
Identifikatoren & physikalische Daten
| CAS No. | 345-83-5 |
|---|---|
| Summenformel | C13H9FO |
| Durchschnittliche Molmasse | 200,21 g/mol |
| Monoisotopische Masse | 200,06374313 g/mol |
| SMILES | O=C(c1ccccc1)c1ccc(F)cc1 |
| InChIKey | OGTSHGYHILFRHD-UHFFFAOYSA-N |
| PubChem CID | 67663 |
| EC No. | 206-463-7 |
| DTXSID | DTXSID00188059 |
| Lokaler Name | 4-Fluorbenzophenon |
Chemische & physikalische Eigenschaften
| XLogP | 3,5 |
|---|---|
| Polarare Oberfläche (TPSA) | 17,1 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 15 |
| Formalladung | 0 |
| Komplexität | 213 |
| Stoffklassen | Other Classes -> Benzophenones |
| SpringerMaterials Properties | 13C nuclear magnetic resonance spectrum |
| Physical Description | Light beige crystalline powder[Acros Organics MSDS] |
| Schmelzpunkt | 47-49 °C (lit.) |
| Siedepunkt | 159-161 °C (13 mmHg) |
| Dichte | 1.1871 (estimate) |
| Flammpunkt | >230 °F |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Löslichkeit | Benzene, Hexanes |
| Aggregatzustand | Crystalline Powder |
| Farbe | Light beige |
| BRN | 1869800 |
| InChI | InChI=1S/C13H9FO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9H |
| InChIKey | OGTSHGYHILFRHD-UHFFFAOYSA-N |
| SMILES | C(C1=CC=C(F)C=C1)(C1=CC=CC=C1)=O |
| CAS Datenbank | 345-83-5(CAS DataBase Reference) |
| NIST chemische Informationen | Benzophenone, 4-fluoro-(345-83-5) |
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)Aggregated GHS information provided per 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Gefahrenübersicht | An irritant[Acros Organics MSDS] |
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29147000 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26-37/39-24/25-36 |
| Gefahrenklasse | IRRITANTEye Irrit. 2Skin Irrit. 2STOT SE 3 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
4-Fluorobenzophenone is a Wittig reagent.