6-Azidouridine 5'-(Dihydrogen Phosphate)

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Properties Simple | Detailed

Formula C9H12N5O9P
IUPAC Name [(2r,3s,4r,5r)-5-(6-azido-2,4-dioxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 365.193 g·mol−1
Heat of Formation -738.2 ± 16.7 kJ·mol−1
Dipole Moment 13.44 ± 1.08 D
Volume 333.34 Å 3
Surface Area 304.58 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -3.22 ± eV
Point Group Symmetry C1
Synonyms
  • [(2r,3s,4r,5r)-5-(6-azido-2,4-diketo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6-azido-2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6-azido-2,4-dioxo-pyrimidin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6-azido-2,4-dioxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
InChIKey GBBWDDPNGBRVEX-YXZULKJRSA-N
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