HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
N-[(Phenylmethoxy)carbonyl]-L-tyrosine methyl ester
CBZ-Tyr-OMe · Z-L-TYROSINE METHYL ESTER · methyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-(4-hydroxyphenyl)propanoate · Z-Tyr-OMe · Z-L-Tyr-OMe · Cbz-L-Tyr-OMe · Z-TYROSINE-OME · Z-TYR-OME USP/EP/BP
![Molekülstruktur von N-[(Phenylmethoxy)carbonyl]-L-tyrosine methyl ester](/img/chemical/7010613.png)
Identifikatoren & physikalische Daten
| CAS No. | 13512-31-7 |
|---|---|
| Summenformel | C18H19NO5 |
| Durchschnittliche Molmasse | 329,3 g/mol |
| Monoisotopische Masse | 329,12632271 g/mol |
| SMILES | COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)OCc1ccccc1 |
| InChIKey | SLLMDHBKALJDBW-INIZCTEOSA-N |
| PubChem CID | 7010613 |
| EC No. | 603-895-1 |
| DTXSID | DTXSID30426678 |
Chemische & physikalische Eigenschaften
| XLogP | 2,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 84,9 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 5 |
| Frei drehbare Bindungen | 8 |
| Schwere Atome | 24 |
| Formalladung | 0 |
| Komplexität | 400 |
| Schmelzpunkt | 93-97 °C(lit.) |
| Siedepunkt | 528.1±50.0 °C(Predicted) |
| Dichte | 1.249±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| Löslichkeit | Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc. |
| pKa (Säurekonstante) | 9.75±0.15(Predicted) |
| Aggregatzustand | Solid |
| CAS Datenbank | 13512-31-7(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 100% (3 of 3) of all reports.Not ClassifiedAggregated GHS information provided per 3 reports by companies from 1 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Status: Active Update: 20-07-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26424 |
| Hazard Classes and Categories | Not Classified |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 2922498590 |
Anwendungen & Verwendung
Verwenden
N-Cbz-L-tyrosine Methyl Ester is used in preparation of optically active Imidazolidione derivatives from N-Benzyloxycarbonyl-tyrosine Ester via Ethylation, reduction and successive treatment with Methanesulfonyl Chloride, Ethylenediamine and Lithium Hydroxide.