6-(Hydroxyamino)-2(1H)-Pyrimidinone

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Properties Simple | Detailed

Formula C4H5N3O2
IUPAC Name 6-(hydroxyamino)pyrimidin-2-one
Molecular Mass 127.101 g·mol−1
Heat of Formation -109.8 ± 16.7 kJ·mol−1
Dipole Moment 6.51 ± 1.08 D
Volume 136.54 Å 3
Surface Area 146.72 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy 2.17 ± eV
Point Group Symmetry C1
Synonyms
  • 2,4(1h,3h)-pyrimidinedione, 4-oxime
  • 2-hydroxy-4-hydroxylaminopyrimidine
  • 4-(hydroxyamino)-2-pyrimidinol
  • 4-(hydroxyamino)-3h-pyrimidin-2-one
  • n(4)-hydroxycytosine
CAS Number(s)
  • 20555-88-8
InChIKey OSHIQPFXKULOPB-UHFFFAOYSA-N
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