tesofensine
Bezeichnung:tesofensine
CAS-Nr195875-84-4
Englisch Name:tesofensine
CBNumberCB12498844
SummenformelC17H23Cl2NO
Molgewicht328.28
MOL-Datei195875-84-4.mol
tesofensine physikalisch-chemischer Eigenschaften
Siedepunkt | 396.6±42.0 °C(Predicted) |
Dichte | 1.161±0.06 g/cm3(Predicted) |
storage temp. | Store at -20°C |
Löslichkeit | DMF: 2 mg/mL,DMSO: 1 mg/mL,Ethanol: Slightly soluble,PBS (pH 7.2): 0.14 mg/mL |
Aggregatzustand | A solid |
pka | 10.46±0.60(Predicted) |
Farbe | White to off-white |
Stabilität | Hygroscopic |
InChI | InChI=1S/C17H23Cl2NO/c1-3-21-10-14-13(9-12-5-7-17(14)20(12)2)11-4-6-15(18)16(19)8-11/h4,6,8,12-14,17H,3,5,7,9-10H2,1-2H3/t12-,13+,14+,17+/m0/s1 |
InChIKey | VCVWXKKWDOJNIT-ZOMKSWQUSA-N |
SMILES | [C@@]12([H])N(C)[C@@]([H])(CC1)C[C@H](C1=CC=C(Cl)C(Cl)=C1)[C@H]2COCC |