[(2R,5R)-5-(6-Amino-9H-Purin-9-Yl)-3-Hydroxy-2,5-Dihydro-2-Furanyl]Methyl Hydrogen Dimethylphosphoramidate

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Formula C12H17N6O5P
IUPAC Name [(2r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3-hydroxy-2,5-dihydrofuran-2-yl]methoxy-n,n-dimethyl-phosphonamidic acid
Molecular Mass 356.274 g·mol−1
Heat of Formation -771.4 ± 16.7 kJ·mol−1
Dipole Moment 3.62 ± 1.08 D
Volume 383.61 Å 3
Surface Area 314.97 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -0.61 ± eV
Point Group Symmetry C1
Synonyms
  • [(2r,5r)-5-(6-amino-9-purinyl)-3-hydroxy-2,5-dihydrofuran-2-yl]methoxy-n,n-dimethylphosphonamidic acid
  • [(2r,5r)-5-(6-aminopurin-9-yl)-3-hydroxy-2,5-dihydrofuran-2-yl]methoxy-n,n-dimethyl-phosphonamidic acid
  • [(2r,5r)-5-(6-aminopurin-9-yl)-3-hydroxy-2,5-dihydrofuran-2-yl]methoxy-n,n-dimethylphosphonamidic acid
  • adenosine 3',5'-cyclic monophosphodimethylamidate
  • adenosine 3',5'-monophosphodimethylamidate
  • camppn(ch3)2
CAS Number(s)
  • 40732-50-1
InChIKey VXABTMSBTOWWDI-RKDXNWHRSA-N
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