5-(3-{[4-(Benzyloxy)Benzyl]Oxy}Benzyl)-1-[(2-Hydroxyethoxy)Methyl]-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C28H28N2O6
IUPAC Name 5-[[3-[(4-benzyloxyphenyl)methoxy]phenyl]methyl]-1-(2-hydroxyethoxymethyl)pyrimidine-2,4-dione
Molecular Mass 488.532 g·mol−1
Heat of Formation -739.7 ± 16.7 kJ·mol−1
Dipole Moment 3.37 ± 1.08 D
Volume 578.2 Å 3
Surface Area 478.55 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 2.37 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(2-hydroxyethoxymethyl)-5-[[3-[[4-(phenylmethoxy)phenyl]methoxy]phenyl]methyl]pyrimidine-2,4-dione
  • 2,4(1h,3h)-pyrimidinedione, 1-((2-hydroxyethoxy)methyl)-5-((3-((4-(phenylmethoxy)phenyl)methoxy)phenyl)methyl)-
  • 5-(3-(4-benzyloxybenzyloxy)benzyl)-1-((2-hydroxyethoxy)methyl)uracil
  • 5-(benzyloxybenzyloxybenzyl)acyclouridine
  • 5-[3-[4-(benzyloxy)benzyl]oxybenzyl]-1-(2-hydroxyethoxymethyl)pyrimidine-2,4-quinone
  • bbbau
CAS Number(s)
  • 105847-66-3
InChIKey ICNZCFDJXIBTPV-UHFFFAOYSA-N
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