HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexanoic acid
BOC-LYS(Z)-OH · BOC-LYS(CBZ)-OH · BOC-LYS(Z) · BOC-L-LYS(Z)-OH · (S)-6-(((benzyloxy)carbonyl)aMino)-2-((tert-butoxycarbonyl)aMino)hexanoic acid · Boc-L-Lys(Cbz)-OH · N6-Benzyloxycarbonyl-N2-tert-butoxycarbonyl-L-lysine · BOC-Z-LYSINE
![Molekülstruktur von (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexanoic acid](/img/chemical/75439.png)
Identifikatoren & physikalische Daten
| CAS No. | 2389-45-9 |
|---|---|
| Summenformel | C19H28N2O6 |
| Durchschnittliche Molmasse | 380,4 g/mol |
| Monoisotopische Masse | 380,19473662 g/mol |
| SMILES | CC(C)(C)OC(=O)NC(CCCCNC(=O)OCc1ccccc1)C(=O)O |
| InChIKey | BDHUTRNYBGWPBL-UHFFFAOYSA-N |
| PubChem CID | 75439 |
Chemische & physikalische Eigenschaften
| XLogP | 2,8 |
|---|---|
| Polarare Oberfläche (TPSA) | 114 |
| H-Brücken-Donoren | 3 |
| H-Brücken-Akzeptoren | 6 |
| Frei drehbare Bindungen | 12 |
| Schwere Atome | 27 |
| Formalladung | 0 |
| Komplexität | 483 |
| Schmelzpunkt | 75.0 to 79.0 °C |
| Siedepunkt | 587.0±50.0 °C(Predicted) |
| Dichte | 1.176±0.06 g/cm3(Predicted) |
| Brechungsindex | -8 ° (C=2.5, AcOH) |
| Lagerbedingungen | Sealed in dry,Store in freezer, under -20°C |
| Löslichkeit | almost transparency in Acetic acid |
| Aggregatzustand | powder to crystal |
| pKa (Säurekonstante) | 3.99±0.21(Predicted) |
| Farbe | White to Almost white |
| BRN | 1917222 |
| Hauptanwendungen | peptide synthesis |
| InChI | 1S/C19H28N2O6/c1-19(2,3)27-18(25)21-15(16(22)23)11-7-8-12-20-17(24)26-13-14-9-5-4-6-10-14/h4-6,9-10,15H,7-8,11-13H2,1-3H3,(H,20,24)(H,21,25)(H,22,23)/t15-/m0/s1 |
| InChIKey | BDHUTRNYBGWPBL-HNNXBMFYSA-N |
| SMILES | C(O)(=O)[C@H](CCCCNC(OCC1=CC=CC=C1)=O)NC(OC(C)(C)C)=O |
| CAS Datenbank | 2389-45-9(CAS DataBase Reference) |
| EPA chemische Informationen | N2-tert-Butoxycarbonyl-N6-benzyloxycarbonyl lysine (2389-45-9) |
Sicherheit & Vorschriften
| Wassergefährdungsklasse (WGK) | 3 |
|---|---|
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 2924 29 70 |
| Sicherheitshinweise (S) | 24/25 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
Boc-Lys(Z)-OH, is used in the synthesis of Isodesmosine Chloride (I815050), which is a component of elastin.