HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-Oxoimidazolidin-1-carbonylchlorid
Einecs 236-185-1 · TIMTEC-BB SBB004082 · 2-Oxo-1-imidazolidin · Ethyleneallophanoyl chloride · 2-Oxo-imidazolindine-1-carbony · 1-Chlorocarbonyl-2-Imidazolidone · 1-Chloroformyl-2-imidazolidinone · 1-Chlorocarbonyl-2-Imidazollidone
Identifikatoren & physikalische Daten
| CAS No. | 13214-53-4 |
|---|---|
| Summenformel | C4H5ClN2O2 |
| Durchschnittliche Molmasse | 148,55 g/mol |
| Monoisotopische Masse | 148,00395508 g/mol |
| SMILES | O=C(Cl)N1CCNC1=O |
| InChIKey | NXJZQSRAFBHNLI-UHFFFAOYSA-N |
| PubChem CID | 83241 |
| EC No. | 236-185-1 |
| DTXSID | DTXSID20157368 |
| Lokaler Name | 2-Oxoimidazolidin-1-carbonylchlorid |
Chemische & physikalische Eigenschaften
| XLogP | 0,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 49,4 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 9 |
| Formalladung | 0 |
| Komplexität | 159 |
| Schmelzpunkt | 147-151 °C(lit.) |
| Dichte | 1.509±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Inert atmosphere,Room Temperature |
| pKa (Säurekonstante) | 12.62±0.20(Predicted) |
| InChI | 1S/C4H5ClN2O2/c5-3(8)7-2-1-6-4(7)9/h1-2H2,(H,6,9) |
| InChIKey | NXJZQSRAFBHNLI-UHFFFAOYSA-N |
| SMILES | ClC(=O)N1CCNC1=O |
| CAS Datenbank | 13214-53-4(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 40 reports by companies from 3 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 |
| 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
Reactant for ytterbium metal promoted reactionsReactant for synthesis of selenoesters by samarium diiodide induced reductive cleavage of Se-Se bonds