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N-Cbz-d-alanine
Z-D-ALA-OH · Z-D-ALA · CBZ-D-Ala · CBZ-D-ALA-OH · CBZ-D-ALANINE · (2R)-2-{[(benzyloxy)carbonyl]amino}propanoic acid · N-CARBOBENZOXY-D-ALANINE · N-Carbobenzyloxy-D-alanine
Identifikatoren & physikalische Daten
| CAS No. | 26607-51-2 |
|---|---|
| Summenformel | C11H13NO4 |
| Durchschnittliche Molmasse | 223,22 g/mol |
| Monoisotopische Masse | 223,0844579 g/mol |
| SMILES | C[C@@H](NC(=O)OCc1ccccc1)C(=O)O |
| InChIKey | TYRGLVWXHJRKMT-MRVPVSSYSA-N |
| PubChem CID | 70832 |
| ChEMBL | CHEMBL367937 |
| EC No. | 688-913-6 |
Chemische & physikalische Eigenschaften
| XLogP | 1,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 75,6 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 4 |
| Frei drehbare Bindungen | 5 |
| Schwere Atome | 16 |
| Formalladung | 0 |
| Komplexität | 248 |
| Schmelzpunkt | 83-84°C |
| Siedepunkt | 422.1±38.0 °C(Predicted) |
| Dichte | 1.246±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| Löslichkeit | almost transparency in Methanol |
| Aggregatzustand | Crystalline Powder |
| pKa (Säurekonstante) | 4.00±0.10(Predicted) |
| Farbe | White to off-white |
| BRN | 2056163 |
| InChI | InChI=1S/C11H13NO4/c1-8(10(13)14)12-11(15)16-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,12,15)(H,13,14)/t8-/m1/s1 |
| InChIKey | TYRGLVWXHJRKMT-MRVPVSSYSA-N |
| SMILES | C(O)(=O)[C@@H](C)NC(OCC1=CC=CC=C1)=O |
| CAS Datenbank | 26607-51-2(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | Not ClassifiedReported as not meeting GHS hazard criteria by 1 of 1 companies. For more detailed information, please visit ECHA C&L website. |
|---|---|
| Hazard Classes and Categories | Not Classified |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29224999 |
| Sicherheitshinweise (S) | 22-24/25 |
Anwendungen & Verwendung
Verwenden
N-Cbz-D-alanine is the Cbz-protected form of D-Alanine (A480995). D-Alanine is an amino acid that is commonly found in bacteria, such as Streptococcus faecalis. It is essential for the biosynthesis of peptidoglycan crosslinking sub-units that are used for bacterial cell walls. D-Alanine is also known to cause cytotoxic oxidative stress in brain tumour cells.