873436-91-0

Name 6-Amino-8-[(6-iodo-1,3-benzodioxol-5-yl)thio]-N-(1-methylethyl)-9H-purine-9-propanamine
CAS 873436-91-0
Molecular Formula C18H21IN6O2S
MDL Number MFCD28952784
Molecular Weight 512.37
MOL File 873436-91-0.mol
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Chemical Properties

Melting point  >194oC (dec.)
Boiling point  650.6±65.0 °C(Predicted)
density  1.84
storage temp.  Keep in dark place,Inert atmosphere,2-8°C
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 10.16±0.29(Predicted)
color  Off-White to Pale Beige
InChI InChI=1S/C18H21IN6O2S/c1-10(2)21-4-3-5-25-17-15(16(20)22-8-23-17)24-18(25)28-14-7-13-12(6-11(14)19)26-9-27-13/h6-8,10,21H,3-5,9H2,1-2H3,(H2,20,22,23)
InChIKey SUPVGFZUWFMATN-UHFFFAOYSA-N
SMILES N1C2C(=NC=NC=2N)N(CCCNC(C)C)C=1SC1=C(I)C=C2OCOC2=C1

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