5,5-Diethyl-2-Isopropoxy-4,6(1H,5H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C11H18N2O3
IUPAC Name 5,5-diethyl-2-isopropoxy-1h-pyrimidine-4,6-dione
Molecular Mass 226.272 g·mol−1
Heat of Formation -606.9 ± 16.7 kJ·mol−1
Dipole Moment 3.34 ± 1.08 D
Volume 282.14 Å 3
Surface Area 249.55 Å 2
HOMO Energy -9.98 ± 0.55 eV
LUMO Energy -0.35 ± eV
Point Group Symmetry C1
Synonyms
  • 2-o-isopropyl barbitone
  • 4,6(1h,5h)-pyrimidinedione, 5,5-diethyl-2-(1-methylethoxy)-
  • 4,6(1h,5h)-pyrimidinedione, 5,5-diethyl-2-isopropoxy-
  • 5,5-diethyl-2-isopropoxy-1h-pyrimidine-4,6-dione
  • 5,5-diethyl-2-isopropoxy-1h-pyrimidine-4,6-quinone
  • 5,5-diethyl-2-propan-2-yloxy-1h-pyrimidine-4,6-dione
CAS Number(s)
  • 85445-03-0
InChIKey GWBJKDRJBWUMFT-UHFFFAOYSA-N
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