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4-Fluor-4'-methoxybenzophenon
4-Fluoro-4'-methoxyb · uoro-4'-methoxybenzophenone · 4-Fluoro-4'-methoxybenzophenone · 4-Fluoro-4'-methoxylbenzophenone · 4-Fluoro-4'-methoxybenzophenone98% · 4-Fluoro-4'-methoxybenzophenone 98% · 4-Fluorophenyl(4-methoxyphenyl) ketone · TIANFU-CHEM 4-Fluoro-4'-methoxybenzophenone
Identifikatoren & physikalische Daten
| CAS No. | 345-89-1 |
|---|---|
| Summenformel | C14H11FO2 |
| Durchschnittliche Molmasse | 230,23 g/mol |
| Monoisotopische Masse | 230,07430781 g/mol |
| SMILES | COc1ccc(C(=O)c2ccc(F)cc2)cc1 |
| InChIKey | VWGWRNBIAWTWIB-UHFFFAOYSA-N |
| PubChem CID | 67664 |
| EC No. | 206-464-2 |
| DTXSID | DTXSID10188060 |
| Lokaler Name | 4-Fluor-4'-methoxybenzophenon |
Chemische & physikalische Eigenschaften
| XLogP | 3,5 |
|---|---|
| Polarare Oberfläche (TPSA) | 26,3 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 17 |
| Formalladung | 0 |
| Komplexität | 251 |
| SpringerMaterials Properties | 13C nuclear magnetic resonance spectrum |
| Schmelzpunkt | 90-92°C |
| Siedepunkt | 208-212 °C(Press: 22 Torr) |
| Dichte | 1.176±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Aggregatzustand | Crystalline Powder |
| Farbe | White |
| InChI | InChI=1S/C14H11FO2/c1-17-13-8-4-11(5-9-13)14(16)10-2-6-12(15)7-3-10/h2-9H,1H3 |
| InChIKey | VWGWRNBIAWTWIB-UHFFFAOYSA-N |
| SMILES | C(C1=CC=C(F)C=C1)(C1=CC=C(OC)C=C1)=O |
| CAS Datenbank | 345-89-1(CAS DataBase Reference) |
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. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| Wassergefährdungsklasse (WGK) | WGK 3 |
| Zollcode | 2914500090 |
| R-Sätze (R) | 36/37/38 |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 26-36 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
(4-Fluorophenyl)(4-methoxyphenyl)methanone
Herstellung & Synthese
synthetische
Obtained by reaction of p-fluorobenzoyl chloride with anisole in the presence of –aluminium chloride in carbon disulfide at r.t. for 1 h (75%).