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203395-82-8

Name 2-Deschloro Aripiprazole
CAS 203395-82-8
Molecular Formula C23H28ClN3O2
MDL Number MFCD23380767
Molecular Weight 413.94
MOL File 203395-82-8.mol
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Chemical Properties

Melting point  100-102°C
Boiling point  626.9±55.0 °C(Predicted)
density  1.206±0.06 g/cm3(Predicted)
storage temp.  Refrigerator
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Solid
pka 14.42±0.20(Predicted)
color  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

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