1-Phenethylpyrimidine-2,4,6(1H,3H,5H)-Trione

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Properties Simple | Detailed

Formula C12H12N2O3
IUPAC Name 1-(2-phenylethyl)hexahydropyrimidine-2,4,6-trione
Molecular Mass 232.235 g·mol−1
Heat of Formation -468.6 ± 16.7 kJ·mol−1
Dipole Moment 0.78 ± 1.08 D
Volume 271.72 Å 3
Surface Area 251.29 Å 2
HOMO Energy -9.67 ± 0.55 eV
LUMO Energy 2.55 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(2-phenylethyl)-1,3-diazinane-2,4,6-trione
  • 1-(2-phenylethyl)-2,4,6(1h,3h,5h)-pyrimidinetrione
  • 1-(2-phenylethyl)barbituric acid
  • 1-phenethyl-pyrimidine-2,4,6-trione
  • bas 02374589
  • oprea1_079961
  • oprea1_166026
  • pyrimidine-2,4,6(1h,3h,5h)-trione, 1-(2-phenylethyl)-
InChIKey MHIKXQXNKSZIGX-UHFFFAOYSA-N
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