685847-78-3

Name Melphalan N-Oxide
CAS 685847-78-3
Molecular Formula C13H18Cl2N2O3
Molecular Weight 321.2
MOL File 685847-78-3.mol
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Chemical Properties

pka 2.08±0.10(Predicted)
InChI InChI=1S/C13H18Cl2N2O3/c14-5-7-17(20,8-6-15)11-3-1-10(2-4-11)9-12(16)13(18)19/h1-4,12H,5-9,16H2,(H,18,19)/t12-/m0/s1
InChIKey GSKQMLGAUOTSKT-LBPRGKRZSA-N
SMILES C(O)(=O)[C@H](CC1=CC=C([N+](CCCl)(CCCl)[O-])C=C1)N

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