5-Ethyl-2-(Hydroxyamino)-5-Propyl-4,6(1H,5H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C9H15N3O3+
IUPAC Name (5r)-5-ethyl-2-(hydroxyamino)-5-propyl-1h-pyrimidine-4,6-dione
Molecular Mass 213.234 g·mol−1
Heat of Formation -415.4 ± 16.7 kJ·mol−1
Dipole Moment 3.12 ± 1.08 D
Volume 255.53 Å 3
Surface Area 233.41 Å 2
HOMO Energy -10.08 ± 0.55 eV
LUMO Energy -0.83 ± eV
Point Group Symmetry C1
Synonyms
  • 2,4,6(1h,3h,5h)-pyrimidinetrione, 5-ethyl-5-propyl-, 2-oxime
  • 2-hydroxylamino-5-ethyl-5-propylbarbituric acid
  • 5-ethyl-2-(hydroxyamino)-5-propyl-1h-pyrimidine-4,6-dione
  • 5-ethyl-2-(hydroxyamino)-5-propyl-1h-pyrimidine-4,6-quinone
  • hb 2
  • hb-2
CAS Number(s)
  • 102902-43-2
InChIKey XIMHYJMEMACSBZ-UHFFFAOYSA-N
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