HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
4-Fluorphenethylalkohol
2-(4-Fluorophenyl)ethan-1-ol · uorophenethyL · 4-Fluorophenethyl al · 4-Fluorophenylethanol · 4-Fluorobenzeneethanol · Benzeneethanol,4-fluoro- · 2-(4-Fuorophenyl)ethanol · 4-fluorophenethyl alcohl
Identifikatoren & physikalische Daten
| CAS No. | 7589-27-7 |
|---|---|
| Summenformel | C8H9FO |
| Durchschnittliche Molmasse | 140,15 g/mol |
| Monoisotopische Masse | 140,06374313 g/mol |
| SMILES | OCCc1ccc(F)cc1 |
| InChIKey | MWUVGXCUHWKQJE-UHFFFAOYSA-N |
| PubChem CID | 82068 |
| EC No. | 231-499-5 |
| DTXSID | DTXSID30226812 |
| Lokaler Name | 4-Fluorphenethylalkohol |
Chemische & physikalische Eigenschaften
| XLogP | 0,9 |
|---|---|
| Polarare Oberfläche (TPSA) | 20,2 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 87,3 |
| Arzneimittel | Pharmaceuticals -> Listed in ZINC15 |
| Siedepunkt | 110°C 20mm |
| Dichte | 1.121 g/mL at 25 °C (lit.) |
| Brechungsindex | n20/D 1.507(lit.) |
| Flammpunkt | 220 °F |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| pKa (Säurekonstante) | 14.84±0.10(Predicted) |
| Aggregatzustand | Liquid |
| Wichte | 1.121 |
| Farbe | Clear colorless |
| BRN | 2354310 |
| InChI | 1S/C8H9FO/c9-8-3-1-7(2-4-8)5-6-10/h1-4,10H,5-6H2 |
| InChIKey | MWUVGXCUHWKQJE-UHFFFAOYSA-N |
| SMILES | OCCc1ccc(F)cc1 |
| CAS Datenbank | 7589-27-7(CAS DataBase Reference) |
| NIST chemische Informationen | Benzeneethanol, 4-fluoro-(7589-27-7) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (14.3%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 7 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (14.3%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29062990 |
| R-Sätze (R) | 36/37/38-21/22-34 |
| Gefahrensymbole | Xn,Xi,F,C |
| Sicherheitshinweise (S) | 23-24/25-36/37/39-26-45-27 |
| Gefahrenklasse | IRRITANT |
| Lagerklasse | 10 - Combustible liquids |
Anwendungen & Verwendung
Verwenden
4-Fluorophenethyl alcohol was used to prepare 1-fluoro-4-(2-iodoethyl)benzene.