HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
4-Bromo-2-fluoroanisole
4-Bromo-2-fluoro-1-methoxybenzene · 4-Br-2-F-anisole · 4-Bromo-2-fluoroanis · 4-Cyano-fluoro phenol · Fluoro-4-bromoanisole · 4-BROMO-2-FLUOROANISOLE · 2-FLUORO-4-BROMOANISOLE · 2-Fluoro-4-Bromo Anisol
Identifikatoren & physikalische Daten
| CAS No. | 2357-52-0 |
|---|---|
| Summenformel | C7H6BrFO |
| Durchschnittliche Molmasse | 205,02 g/mol |
| Monoisotopische Masse | 203,95860513 g/mol |
| SMILES | COc1ccc(Br)cc1F |
| InChIKey | DWNXGZBXFDNKOR-UHFFFAOYSA-N |
| PubChem CID | 75378 |
| EC No. | 219-096-2 |
| DTXSID | DTXSID80178195 |
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 |
| Schmelzpunkt | 16 °C |
| Siedepunkt | 84 °C/7 mmHg (lit.) |
| Dichte | 1.59 g/mL at 25 °C (lit.) |
| Brechungsindex | n20/D 1.545(lit.) |
| Flammpunkt | 209 °F |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Aggregatzustand | clear liquid |
| Farbe | Colorless to Light yellow |
| Wichte | 1.590 |
| Löslichkeit | insoluble |
| BRN | 3240714 |
| InChI | InChI=1S/C7H6BrFO/c1-10-7-3-2-5(8)4-6(7)9/h2-4H,1H3 |
| InChIKey | DWNXGZBXFDNKOR-UHFFFAOYSA-N |
| SMILES | C1(OC)=CC=C(Br)C=C1F |
| CAS Datenbank | 2357-52-0(CAS DataBase Reference) |
| NIST chemische Informationen | 4-Bromo-2-fluoroanisole(2357-52-0) |
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 47 reports by companies from 6 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
4-Bromo-2-fluoroanisole has been used in the synthesis of:1,4-bis[(3′-fluoro-4′-n alkoxyphenyl)ethynyl]benzenes with n=1-127-fluoro-6-methoxy-1-methyl-2-naphthaldehyde5,7-difluoro-6-methoxy-1-methyl-2-naphthaldehydeliquid crystals with terminal difluoromethoxy group and backbone of phenylbicyclohexane