HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-(3-Pyridyl)thiazole-4-carboxylic acid
BUTTPARK 98\12-24 · 2-(3-pyridinyl)-4-thiazolecarboxylic acid · 2-PYRIDIN-3-YL-THIAZOLE-4-CARBOXYLIC ACID · 4-Thiazolecarboxylicacid, 2-(3-pyridinyl)- · 2-(3-PYRIDYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID · 2-(3-Pyridyl)thiazole-4-carboxylic acid, 97% · 2-(3-PYRIDINYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID · 2-(Pyridin-3-yl)-1,3-thiazole-4-carboxylic acid
Identifikatoren & physikalische Daten
| CAS No. | 39067-29-3 |
|---|---|
| Summenformel | C9H6N2O2S |
| Durchschnittliche Molmasse | 206,22 g/mol |
| Monoisotopische Masse | 206,01499843 g/mol |
| SMILES | O=C(O)c1csc(-c2cccnc2)n1 |
| InChIKey | FOQFGMAZUTUELM-UHFFFAOYSA-N |
| PubChem CID | 736513 |
| EC No. | 670-393-7 |
| DTXSID | DTXSID00353048 |
Chemische & physikalische Eigenschaften
| XLogP | 1,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 91,3 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 5 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 14 |
| Formalladung | 0 |
| Komplexität | 225 |
| Schmelzpunkt | 283 °C |
| Siedepunkt | 460.3±51.0 °C(Predicted) |
| Dichte | 1.440±0.06 g/cm3(Predicted) |
| Lagerbedingungen | 2-8°C |
| pKa (Säurekonstante) | 3.29±0.10(Predicted) |
| CAS Datenbank | 39067-29-3 |
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 35 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| Zollcode | 2934100090 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26-36/37/39 |
| Gefahrenklasse | IRRITANT |
Anwendungen & Verwendung
Verwenden
2-(3-Pyridyl)thiazole-4-carboxylic acid is a pyridylthiazole compound that has use in a variety of diverse applications from highly luminescent heterocyclic compounds to potential antiulcer drugs, to the formation of double and triple helicates with Cu(II) and to the mesoscopically ordered pH-responsive hybrid materials.