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Fmoc-cycloleucine
Fmoc-cLeu-OH · FMOC-CLE-OH · FMOC-AC5C-OH · CAS:117322-30-2 · FMOC-CYCLOLEUCINE · FMOC-NH(1)CPEN-OH · 1-(Fmoc-amino)cycL · RARECHEM EM WB 0031
Identifikatoren & physikalische Daten
| CAS No. | 117322-30-2 |
|---|---|
| Summenformel | C21H21NO4 |
| Durchschnittliche Molmasse | 351,4 g/mol |
| Monoisotopische Masse | 351,14705815 g/mol |
| SMILES | O=C(NC1(C(=O)O)CCCC1)OCC1c2ccccc2-c2ccccc21 |
| InChIKey | IECZEINPZOFWNU-UHFFFAOYSA-N |
| PubChem CID | 978345 |
| EC No. | 851-210-1 |
| DTXSID | DTXSID50359656 |
Chemische & physikalische Eigenschaften
| XLogP | 3,7 |
|---|---|
| Polarare Oberfläche (TPSA) | 75,6 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 4 |
| Frei drehbare Bindungen | 5 |
| Schwere Atome | 26 |
| Formalladung | 0 |
| Komplexität | 520 |
| Schmelzpunkt | 187 °C(dec.) |
| Siedepunkt | 579.4±29.0 °C(Predicted) |
| Dichte | 1.32±0.1 g/cm3(Predicted) |
| Lagerbedingungen | Inert atmosphere,2-8°C |
| Löslichkeit | soluble in Dimethylformamide |
| Aggregatzustand | powder to crystal |
| pKa (Säurekonstante) | 4.08±0.20(Predicted) |
| Farbe | White to Light yellow |
| BRN | 5995036 |
| CAS Datenbank | 117322-30-2(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.WarningH315 (50%): 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (50%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29242990 |
| Sicherheitshinweise (S) | 22-24/25 |
| Gefahrenklasse | IRRITANT |
Anwendungen & Verwendung
Verwenden
Fmoc-cycloleucine is a reagent in the development of selective inhibitors of nuclear hormone receptors.