8-Azidoinosine 5'-(Dihydrogen Phosphate)

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Properties Simple | Detailed

Formula C10H12N7O8P
IUPAC Name [(2r,3s,4r,5r)-5-(8-azido-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 389.218 g·mol−1
Heat of Formation -1085.3 ± 16.7 kJ·mol−1
Dipole Moment 13.38 ± 1.08 D
Volume 380.94 Å 3
Surface Area 327.0 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy -0.69 ± eV
Point Group Symmetry C1
Synonyms
  • 5'-inosinic acid, 8-azido-
  • 8-azidoinosine 5'-monophosphate
  • 8-azidoinosinic acid
  • [(2r,3s,4r,5r)-5-(8-azido-6-keto-3h-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(8-azido-6-oxo-3h-purin-9-yl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(8-azido-6-oxo-3h-purin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(8-azido-6-oxo-3h-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(8-azido-6-oxo-3h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
CAS Number(s)
  • 74721-48-5
InChIKey QCKRUHHUYCOJGL-UUOKFMHZSA-N
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