2',3'-O-Isopropylideneguanosine

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Properties Simple | Detailed

Formula C13H17N5O5
IUPAC Name 9-[(3ar,4r,6r,6ar)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-2-amino-3,8-dihydropurine-1,2,4,5,7,8-hexaid-6-one
Molecular Mass 323.305 g·mol−1
Heat of Formation -623.1 ± 16.7 kJ·mol−1
Dipole Moment 12.18 ± 1.08 D
Volume 353.12 Å 3
Surface Area 308.5 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy 2.81 ± eV
Point Group Symmetry C1
Synonyms
  • 2',3'-isopropylideneguanosine
  • 9-[(3ar,4r,6r,6ar)-2,2-dimethyl-4-methylol-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]-2-amino-3h-purin-6-one
  • 9-[(3ar,4r,6r,6ar)-4-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]-2-amino-3h-purin-6-one
CAS Number(s)
  • 362-76-5
InChIKey XKPDAYWPKILAMO-IOSLPCCCSA-N
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