HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
L-tert-Leucine
LEUCINE · LEU · H-LEU-OH · Tle · H-L-LEU-OH · L-tertiary leucine · L-Tle-OH · FEMA 3297
Identifikatoren & physikalische Daten
| CAS No. | 20859-02-3 |
|---|---|
| Summenformel | C6H13NO2 |
| Durchschnittliche Molmasse | 131,17 g/mol |
| Monoisotopische Masse | 131,09462866 g/mol |
| SMILES | CC(C)(C)[C@H](N)C(=O)O |
| InChIKey | NPDBDJFLKKQMCM-SCSAIBSYSA-N |
| PubChem CID | 164608 |
| EC No. | 424-750-7 |
| DTXSID | DTXSID001017204 |
Chemische & physikalische Eigenschaften
| XLogP | -1,8 |
|---|---|
| Polarare Oberfläche (TPSA) | 63,3 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 9 |
| Formalladung | 0 |
| Komplexität | 115 |
| Schmelzpunkt | ≥300 °C (lit.) |
| Siedepunkt | 217.7±23.0 °C(Predicted) |
| Dichte | 1.1720 (estimate) |
| Brechungsindex | -9 ° (C=3, H2O) |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| Löslichkeit | 1 M HCl: 50 mg/mL125.5 g/L (20 ºC) |
| Aggregatzustand | powder |
| pKa (Säurekonstante) | 2.39±0.12(Predicted) |
| Farbe | White to almost white |
| BRN | 1721824 |
| Hauptanwendungen | peptide synthesis |
| InChI | 1S/C6H13NO2/c1-6(2,3)4(7)5(8)9/h4H,7H2,1-3H3,(H,8,9)/t4-/m1/s1 |
| InChIKey | NPDBDJFLKKQMCM-SCSAIBSYSA-N |
| SMILES | CC(C)(C)[C@H](N)C(O)=O |
| CAS Datenbank | 20859-02-3(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 100% (4 of 4) of all reports.Not ClassifiedAggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Status: Active Update: 22-07-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/32457L-Valine, 3-methyl-: Does not have an individual approval but may be used under an appropriate group standard |
| Hazard Classes and Categories | Not Classified |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29224999 |
| RTECS-Nr. | OH2850000 |
| Gefahrensymbole | Xi |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 22-24/25 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
L-tert-Leucine is an essential amino acid and makes up one third of our muscle protein. It can be used as a food additive. It is used in the formation of sterols. It is used in the production of cobalt oxazoline palladacycles complex, which acts as a catalyst in the rearrangement of prochiral N-aryl trifluoroacetimidates to allylic amides yielded in significantly higher enantioselectivities with the (S)-(pR)-diasteroisomer.