HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
4-Fluorbenzylalkohol
(4-Fluorophenyl)methanol · NSC 63347 · RARECHEM AL BD 0076 · 4-Fluorobenzyl Alco · 4-Fluorobenzyl alcoh · 4-Fluorobenzylaclohol · 4-FLUOROBENZYL ALCOHOL · P-FLUOROBENZYL ALCOHOL
Identifikatoren & physikalische Daten
| CAS No. | 459-56-3 |
|---|---|
| Summenformel | C7H7FO |
| Durchschnittliche Molmasse | 126,13 g/mol |
| Monoisotopische Masse | 126,04809301 g/mol |
| SMILES | OCc1ccc(F)cc1 |
| InChIKey | GEZMEIHVFSWOCA-UHFFFAOYSA-N |
| PubChem CID | 68022 |
| EC No. | 207-292-0 |
| DTXSID | DTXSID4075409 |
| Lokaler Name | 4-Fluorbenzylalkohol |
Chemische & physikalische Eigenschaften
| XLogP | 1,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 20,2 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 9 |
| Formalladung | 0 |
| Komplexität | 77 |
| Schmelzpunkt | 23°C |
| Siedepunkt | 204-206 °C |
| Dichte | 1.156 g/mL at 25 °C(lit.) |
| Brechungsindex | n20/D 1.507(lit.) |
| Flammpunkt | 194 °F |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| pKa (Säurekonstante) | 14.29±0.10(Predicted) |
| Aggregatzustand | powder to lump to clear liquid |
| Farbe | White or Colorless to Light yellow |
| Wichte | 1.156 |
| Löslichkeit | Slightly soluble in water. |
| BRN | 1446930 |
| InChI | 1S/C7H7FO/c8-7-3-1-6(5-9)2-4-7/h1-4,9H,5H2 |
| InChIKey | GEZMEIHVFSWOCA-UHFFFAOYSA-N |
| SMILES | OCc1ccc(F)cc1 |
| CAS Datenbank | 459-56-3(CAS DataBase Reference) |
| NIST chemische Informationen | 4-Fluorobenzyl alcohol(459-56-3) |
| EPA chemische Informationen | Benzenemethanol, 4-fluoro- (459-56-3) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 16.7% (1 of 6) of reports.WarningH315 (83.3%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (83.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (83.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract 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 6 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Reported as not meeting GHS hazard criteria per 1 of 6 reports by companies.There are 4 notifications provided by 5 of 6 reports by companies with hazard statement code(s).Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (83.3%)Eye Irrit. 2A (83.3%)STOT SE 3 (83.3%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29062900 |
| R-Sätze (R) | 14-34-36/37 |
| Gefahrensymbole | Xi,C |
| Sicherheitshinweise (S) | 23-24/25-45-36/37/39-27-26 |
| Gefahrenklasse | IRRITANT |
| Lagerklasse | 10 - Combustible liquids |
Anwendungen & Verwendung
Verwenden
4-Fluorobenzyl Alcohol has been used in the preparation of many compounds including amides.