HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
6-Fluoropyridine-2-carboxylic acid
6-FLUOROPICOLINIC ACID · 65753 · 2-Fluoroyridine-6 · uoro-2-pyridinecarboxyL · 5-Amino-6-chloro-4-picoline · 2-Fluoroyridine-6-carboxylicacid · 2-Fluoropyridine-6-carboxylicaci · 6-Fluoro-2-pyridinecarboxylicacid
Identifikatoren & physikalische Daten
| CAS No. | 402-69-7 |
|---|---|
| Summenformel | C6H4FNO2 |
| Durchschnittliche Molmasse | 141,1 g/mol |
| Monoisotopische Masse | 141,02260659 g/mol |
| SMILES | O=C(O)c1cccc(F)n1 |
| InChIKey | DIEMCUFYSOEIDU-UHFFFAOYSA-N |
| PubChem CID | 226027 |
| EC No. | 637-034-6 |
| DTXSID | DTXSID00280229 |
Chemische & physikalische Eigenschaften
| XLogP | 1,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 50,2 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 4 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 140 |
| Schmelzpunkt | 139-143 °C (lit.) |
| Siedepunkt | 306.3±22.0 °C(Predicted) |
| Dichte | 1.419±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| pKa (Säurekonstante) | 3.30±0.10(Predicted) |
| Aggregatzustand | Powder or Crystalline Powder |
| Farbe | White to yellow to pale brown |
| InChI | 1S/C6H4FNO2/c7-5-3-1-2-4(8-5)6(9)10/h1-3H,(H,9,10) |
| InChIKey | DIEMCUFYSOEIDU-UHFFFAOYSA-N |
| SMILES | OC(=O)c1cccc(F)n1 |
| CAS Datenbank | 402-69-7(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)Aggregated GHS information provided per 49 reports by companies from 8 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 | 29333990 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26-36 |
| Gefahrenklasse | IRRITANTEye Irrit. 2Skin Irrit. 2STOT SE 3 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
2-Fluoropyridine-6-carboxylic acid serves as a ligand in the synthesis of Cu(II) metal complexes [5].