2-Isopropyladenosine 5'-(Dihydrogen Phosphate)

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Properties Simple | Detailed

Formula C13H20N5O7P
IUPAC Name [(2r,3s,4r,5r)-5-(6-amino-2-isopropyl-purine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 389.301 g·mol−1
Heat of Formation -1402.2 ± 16.7 kJ·mol−1
Dipole Moment 2.74 ± 1.08 D
Volume 415.68 Å 3
Surface Area 358.68 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
Synonyms
  • 5'-adenylic acid, 2-(1-methylethyl)-, homopolymer
  • [(2r,3s,4r,5r)-5-(6-amino-2-isopropyl-9-purinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6-amino-2-isopropyl-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6-amino-2-propan-2-yl-purin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6-amino-2-propan-2-ylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
  • poly(2'-isopropyladenylic acid)
CAS Number(s)
  • 66454-80-6
InChIKey QGTFQPJASUNCSJ-HTVVRFAVSA-N
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