1,3-Diallyl-5-Ethyl-5-(3-Methylbutyl)-2,4,6(1H,3H,5H)-Pyrimidinetrione

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Formula C17H26N2O3
IUPAC Name 1,3-diallyl-5-ethyl-5-isopentyl-hexahydropyrimidine-2,4,6-trione
Molecular Mass 306.400 g·mol−1
Heat of Formation -563.4 ± 16.7 kJ·mol−1
Dipole Moment 1.00 ± 1.08 D
Volume 407.61 Å 3
Surface Area 333.19 Å 2
HOMO Energy -10.28 ± 0.55 eV
LUMO Energy 2.88 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-diallyl-5-ethyl-5-isoamyl-barbituric acid
  • 1,3-diallyl-5-ethyl-5-isopentylhexahydropyrimidine-2,4,6-trione
  • 2,4,6(1h,3h,5h)-pyrimidinetrione, 5-ethyl-5-(3-methylbutyl)-1,3-di-2-propenyl-
  • 5-ethyl-5-(3-methylbutyl)-1,3-di(prop-2-enyl)-1,3-diazinane-2,4,6-trione
  • n,n-dapb
  • n,n-diallylpentobarbital
CAS Number(s)
  • 95575-11-4
InChIKey WOOJIBVDNKTPDJ-UHFFFAOYSA-N
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