254912-63-5

Name 2,3-Dehydro Ketoconazole
CAS 254912-63-5
Molecular Formula C26H26Cl2N4O4
MDL Number MFCD30543635
Molecular Weight 529.41
MOL File 254912-63-5.mol

Chemical Properties

Boiling point  736.8±60.0 °C(Predicted)
density  1.37±0.1 g/cm3(Predicted)
pka 6.88±0.12(Predicted)
InChIKey GHVFISLXKPKRQU-GRHWAJSLNA-N
SMILES C(=O)(N1C=CN(C2=CC=C(OC[C@H]3CO[C@@](C4=CC=C(Cl)C=C4Cl)(CN4C=NC=C4)O3)C=C2)CC1)C |&1:12,15,r|

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