Grundinformationen
- Standard-SMILES
CC(C)(C)[C@@H](N)CO- InChIKey
JBULSURVMXPBNA-YFKPBYRVSA-N- Summenformel
- C6H15NO
- Durchschnittliche Molmasse
- 117,19 g/mol
- Monoisotopische Masse
- 117,1153641
Namen und Bezeichner
- Bevorzugter Name
- (2R)-2-Amino-3,3-dimethylbutan-1-ol
- IUPAC
- (2R)-2-amino-3,3-dimethylbutan-1-ol
- Englischer Name
- (R)-TERT-LEUCINOL
- Summenformel
- C6H15NO
- Molmasse
- 117.19
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
112245-09-7- PubChem CID
- 6932847
- DTXSID
DTXSID60426146- EC Number
- 634-525-7
- Nikkaji
- J1.052.699J
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,4
- Polarare Oberfläche (TPSA)
- 46,3 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 8
- Formalladung
- 0
- Komplexität
- 65
Physikochemische Eigenschaften
- Schmelzpunkt
- 30 · 30-33 °C(lit.)
- Siedepunkt
- 70 °C0.4 · 70 °C0.4 mm Hg(lit.)
- Dichte
- 0.9 g/mL · 0.9 g/mL at 25 °C(lit.)
- Flammpunkt
- 194 °F · 194 °F
- storage temp.
- 2 · Keep in dark place,Inert atmosphere,2-8°C
- Aggregatzustand
- Liquid
- pka
- 12.88 · 12.88±0.10(Predicted)
- Farbe
- Colorless to yellow
- Major Application
- peptide synthesis
- InChI
- InChI=1S/C6H15NO/c1-6(2,3)5(7)4-8/h5,8H,4,7H2,1-3H3/t5-/m0/s1
- InChIKey
- JBULSURVMXPBNA-YFKPBYRVSA-N
- SMILES
- C(O)[C@H](N)C(C)(C)C
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 45 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2922190090
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
Verwenden(R)-Tert-leucinol (H-D-Tle-ol) is a chiral molecular compound with optical activity and its enantiomeric form is (S)-tert-leucinol. (R)-Tert-leucinol belongs to the class of α-amino alcohols, which have certain biological activities and are potent reversible inhibitors of protein synthesis. (R)-Tert-leucinol can be used as a chiral ligand for asymmetric catalytic reactions. Its derivatives are also used as optical splitting reagents, for peptidyl alcohol synthesis in peptide drugs, and as inhibitors of protein hydrolysis.
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