2-Deschloro Aripiprazole
Bezeichnung:2-Deschloro Aripiprazole
CAS-Nr203395-82-8
Englisch Name:2-Deschloro Aripiprazole
CBNumberCB62652434
SummenformelC23H28ClN3O2
Molgewicht413.94
MOL-Datei203395-82-8.mol
2-Deschloro Aripiprazole physikalisch-chemischer Eigenschaften
Schmelzpunkt | 100-102°C |
Siedepunkt | 626.9±55.0 °C(Predicted) |
Dichte | 1.206±0.06 g/cm3(Predicted) |
storage temp. | Refrigerator |
Löslichkeit | Chloroform (Slightly), Methanol (Slightly) |
Aggregatzustand | Solid |
pka | 14.42±0.20(Predicted) |
Farbe | White to Off-White |
InChI | InChI=1S/C23H28ClN3O2/c24-19-4-3-5-20(16-19)27-13-11-26(12-14-27)10-1-2-15-29-21-8-6-18-7-9-23(28)25-22(18)17-21/h3-6,8,16-17H,1-2,7,9-15H2,(H,25,28) |
InChIKey | SHHUSQIOAKPGMO-UHFFFAOYSA-N |
SMILES | N1C2=C(C=CC(OCCCCN3CCN(C4=CC=CC(Cl)=C4)CC3)=C2)CCC1=O |