8-Bromoadenosine 5'-(Dihydrogen Phosphate)

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Properties Simple | Detailed

Formula C10H13BrN5O7P
IUPAC Name [(2r,3s,4r,5r)-5-(6-amino-8-bromo-purine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 426.117 g·mol−1
Heat of Formation -1288.7 ± 16.7 kJ·mol−1
Dipole Moment 2.82 ± 1.08 D
Volume 370.43 Å 3
Surface Area 316.78 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy 2.16 ± eV
Point Group Symmetry C1
Synonyms
  • 5'-adenylic acid, 8-bromo-, homopolymer
  • 8-bromo-adenosine-5'-monophosphate
  • 8br
  • [(2r,3s,4r,5r)-5-(6-amino-8-bromo-9-purinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6-amino-8-bromo-purin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6-amino-8-bromo-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6-amino-8-bromopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
  • adenosine, 8-bromo-, 5'-(dihydrogen phosphate)
  • poly 8-bromoadenylic acid
  • poly(8-bra)
  • poly(8-bromoriboadenylic acid)
CAS Number(s)
  • 23567-96-6
  • 50828-34-7
InChIKey DNPIJKNXFSPNNY-UUOKFMHZSA-N
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Elements C H O N P Br