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[[(4-Ethyl-2,3-dioxopiperazin-1-yl)carbonyl]amino](4-hydroxyphenyl)essigsure
{[(4-Ethyl-2 · Einecs 279-328-3 · 4-ethyl-N-(4-hydroxyphenyl)-2,3-dioxo-1-piperazinecarboxamide · 3-Dioxo-1-Piperazinyl) Carbonyl]Amino}-4-Hydroxy-Benzene Acetic Acid · 2-(4-Ethyl-2,3-dioxopiperazine-1-carboxamido)-2-(4-hydroxyphenyl)acetic Acid · α-[[(4-Ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino]-4-hydroxybenzeneacetic Acid · {[(4-Ethyl-2,3-Dioxo-1-Piperazinyl) Carbonyl]Amino}-4-Hydroxy-Benzene Acetic Acid · D-(-)-4-Ethyl-2,3-dioxo-1-piperazine amide-p-Hydroxybenzene Acetic acid (HO-EPCP)
![Molekülstruktur von [[(4-Ethyl-2,3-dioxopiperazin-1-yl)carbonyl]amino](4-hydroxyphenyl)essigsure](/img/chemical/3018895.png)
Identifikatoren & physikalische Daten
| CAS No. | 79868-75-0 |
|---|---|
| Summenformel | C15H17N3O6 |
| Durchschnittliche Molmasse | 335,31 g/mol |
| SMILES | CCN1CCN(C(=O)NC(C(=O)O)c2ccc(O)cc2)C(=O)C1=O |
| InChIKey | IPARGUVYMOMVNU-UHFFFAOYSA-N |
| PubChem CID | 3018895 |
| EC No. | 279-328-3 |
| Lokaler Name | [[(4-Ethyl-2,3-dioxopiperazin-1-yl)carbonyl]amino](4-hydroxyphenyl)essigsure |
Chemische & physikalische Eigenschaften
| XLogP | 0,9 |
|---|---|
| Polarare Oberfläche (TPSA) | 127 |
| H-Brücken-Donoren | 3 |
| H-Brücken-Akzeptoren | 6 |
| Frei drehbare Bindungen | 4 |
| Schwere Atome | 24 |
| Formalladung | 0 |
| Komplexität | 529 |
| Dichte | 1.456±0.06 g/cm3(Predicted) |
| pKa (Säurekonstante) | 3.40±0.10(Predicted) |
Sicherheit & Vorschriften
| GHS-Einstufung | Not Classified |
|---|---|
| Hazard Classes and Categories | Not Classified |
Anwendungen & Verwendung
Verwenden
α-[[(4-Ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino]-4-hydroxybenzeneacetic acid is used in the preparation of Cefoperazone an antibiotic.