5-Fluoro-3-(2-Methylbenzoyl)-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C12H9FN2O3++
IUPAC Name 5-fluoro-3-(2-methylbenzoyl)pyrimidine-2,4-dione
Molecular Mass 248.210 g·mol−1
Heat of Formation -530.6 ± 16.7 kJ·mol−1
Dipole Moment 4.96 ± 1.08 D
Volume 266.66 Å 3
Surface Area 242.66 Å 2
HOMO Energy -9.82 ± 0.55 eV
LUMO Energy 2.08 ± eV
Point Group Symmetry C1
Synonyms
  • 5-fluoro-3-(2-methylbenzoyl)uracil
  • 5-fluoro-3-(2-methylphenyl)carbonyl-1h-pyrimidine-2,4-dione
  • 5-fluoro-3-[(2-methylphenyl)-oxomethyl]-1h-pyrimidine-2,4-dione
  • tfu
InChIKey GWSICSYZXMCSNN-UHFFFAOYSA-N
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