HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
(3R)-1-benzylpiperidin-3-amine
C-3101R · CAS:168466-84-0 · Linagliptin Impurity 89 · (R)-1-benzylpiperidin-3-amine · (R)-1-BENZYL-3-AMINOPIPERIDINE · (R)-3-AMINO-1-BENZYL-PIPERIDINE · (r)-n-benzyl-3-amino-piperidine · 1-BENZYL-PIPERIDIN-(R)-3-YLAMINE
Identifikatoren & physikalische Daten
| CAS No. | 168466-84-0 |
|---|---|
| Summenformel | C12H18N2 |
| Durchschnittliche Molmasse | 190,28 g/mol |
| Monoisotopische Masse | 190,14699858 g/mol |
| SMILES | N[C@@H]1CCCN(Cc2ccccc2)C1 |
| InChIKey | HARWNWOLWMTQCC-GFCCVEGCSA-N |
| PubChem CID | 854130 |
| EC No. | 676-160-6 |
| DTXSID | DTXSID20357548 |
Chemische & physikalische Eigenschaften
| XLogP | 1,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 29,3 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 14 |
| Formalladung | 0 |
| Komplexität | 164 |
| Siedepunkt | 281.2±33.0 °C(Predicted) |
| Dichte | 1.037±0.06 g/cm3(Predicted) |
| Flammpunkt | 113℃ |
| Lagerbedingungen | 2-8°C(protect from light) |
| Aggregatzustand | solid |
| pKa (Säurekonstante) | 10.21±0.20(Predicted) |
| Farbe | Yellow |
| Löslichkeit | Slightly soluble in water. |
| CAS Datenbank | 168466-84-0(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH314 (12.5%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 8 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Skin Corr. 1B (12.5%) |
| Zollcode | 29333990 |
| R-Sätze (R) | 25-36/37/38 |
| Gefahrensymbole | Xi,T |
| Sicherheitshinweise (S) | 45-37-26 |
Anwendungen & Verwendung
Verwenden
(R)-3-Amino-1-benzylpiperidine is used as an organic chemical synthesis intermediate.