(+)-(S)-1,3-Dimethyl-6-Oxiranyl-2,4-Pyrimidinedione

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Properties Simple | Detailed

Formula C8H10N2O3++
IUPAC Name 1,3-dimethyl-6-[(2s)-oxiran-2-yl]pyrimidine-2,4-dione
Molecular Mass 182.177 g·mol−1
Heat of Formation -342.0 ± 16.7 kJ·mol−1
Dipole Moment 5.13 ± 1.08 D
Volume 207.11 Å 3
Surface Area 199.87 Å 2
HOMO Energy -9.62 ± 0.55 eV
LUMO Energy -0.54 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-dimethyl-6-[(2s)-2-oxiranyl]pyrimidine-2,4-dione
  • 1,3-dimethyl-6-[(2s)-oxiran-2-yl]pyrimidine-2,4-dione
  • 1,3-dimethyl-6-[(2s)-oxiran-2-yl]pyrimidine-2,4-quinone
  • 1,3-dimethyl-6-oxiranyl-2,4-pyrimidinedione
  • 1,3-dopd
  • 2,4(1h,3h)-pyrimidinedione, 1,3-dimethyl-6-oxiranyl-, (s)-
CAS Number(s)
  • 131699-67-7
InChIKey KIJLLYVGTQXTKZ-ZCFIWIBFSA-N
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