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2-Bromo-4-fluoroanisole
2-BROMO-4-FLUORO-1-METHOXYBENZENE · 2-Bromo-4-fluoroanis · 2-Bromo-4-FlouroAnisole · 2-BROMO-4-FLUOROANISOLE · 4-FLUORO-2-BROMO ANISOLE · 2-Bromo-4-fluoroanisole97% · 2-Bromo-4-fluoroanisole>2-Bromo-4-fluoroanisole,98% · 2-Bromo-4-fluoroanisole 97%
Identifikatoren & physikalische Daten
| CAS No. | 452-08-4 |
|---|---|
| Summenformel | C7H6BrFO |
| Durchschnittliche Molmasse | 205,02 g/mol |
| Monoisotopische Masse | 203,95860513 g/mol |
| SMILES | COc1ccc(F)cc1Br |
| InChIKey | JIQXVIJARQLCOY-UHFFFAOYSA-N |
| PubChem CID | 136292 |
| EC No. | 610-229-3 |
| DTXSID | DTXSID00196417 |
Chemische & physikalische Eigenschaften
| XLogP | 2,7 |
|---|---|
| Polarare Oberfläche (TPSA) | 9,2 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 110 |
| SpringerMaterials Properties | Nuclear quadrupole resonance spectroscopy |
| Siedepunkt | 89 °C/1 mmHg (lit.) |
| Dichte | 1.581 g/mL at 25 °C (lit.) |
| Brechungsindex | n20/D 1.545(lit.) |
| Flammpunkt | 209 °F |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| Aggregatzustand | clear liquid |
| Farbe | Colorless to Light orange to Yellow |
| Wichte | 1.581 |
| BRN | 2358880 |
| InChI | InChI=1S/C7H6BrFO/c1-10-7-3-2-5(9)4-6(7)8/h2-4H,1H3 |
| InChIKey | JIQXVIJARQLCOY-UHFFFAOYSA-N |
| SMILES | C1(OC)=CC=C(F)C=C1Br |
| CAS Datenbank | 452-08-4(CAS DataBase Reference) |
| NIST chemische Informationen | 2-Bromo-4-fluoroanisole(452-08-4) |
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)Aggregated GHS information provided per 48 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29093090 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26-36-24/25 |
| Gefahrenklasse | IRRITANTEye Irrit. 2Skin Irrit. 2STOT SE 3 |
| Lagerklasse | 10 - Combustible liquids |
Anwendungen & Verwendung
Verwenden
2-Bromo-4-fluoroanisole was used in the synthesis of (5-fluoro-2-methoxyphenyl)methanol.