9-[2-(Phosphonomethoxy)Ethyl]Guanine

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Properties Simple | Detailed

Formula C8H12N5O5P
IUPAC Name 2-(2-amino-6-oxo-3h-purin-9-yl)ethoxymethylphosphonic acid
Molecular Mass 289.185 g·mol−1
Heat of Formation 591.2 ± 16.7 kJ·mol−1
Dipole Moment 8.71 ± 1.08 D
Volume 269.61 Å 3
Surface Area 269.26 Å 2
HOMO Energy -10.03 ± 0.55 eV
LUMO Energy -4.49 ± eV
Point Group Symmetry C1
Synonyms
  • ((2-(2-amino-1,6-dihydro-6-oxo-9h-purin-9-yl)ethoxy)methyl)phosphonic acid
  • 2-(2-amino-6-keto-3h-purin-9-yl)ethoxymethylphosphonic acid
  • 2-(2-amino-6-oxo-3h-purin-9-yl)ethoxymethylphosphonic acid
  • 5-(3-hydroxy-2-phosphonomethoxypropylguanine)
  • 9-((2-phosphonylmethoxy)ethyl)guanine
  • 9-(2-phosphonylmethoxyethyl)guanine
  • aids-000272
  • aids-111814
  • aids000272
  • aids111814
  • c11184
  • phosphonic acid, ((2-(2-amino-1,6-dihydro-6-oxo-9h-purin-9-yl)ethoxy)methyl)-
  • phosphonic acid, 2-(2-amino-6-hydroxy-9h-purin-9-yl)ethoxy-methyl-
  • phosphonic acid, [[2-(2-amino-1,6-dihydro-6-oxo-9h-purin-9-yl)ethoxy]methyl]-
  • pmeg
CAS Number(s)
  • 114088-58-3
InChIKey NZVORGQIEFTOQZ-UHFFFAOYSA-N
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