1-Cyclohexyl-5-Methyl-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C11H16N2O2
IUPAC Name 1-cyclohexyl-5-methyl-pyrimidine-2,4-dione
Molecular Mass 208.257 g·mol−1
Heat of Formation -429.7 ± 16.7 kJ·mol−1
Dipole Moment 5.48 ± 1.08 D
Volume 254.0 Å 3
Surface Area 236.06 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy -0.33 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-cyclohexyl-5-methyl-pyrimidine-2,4-quinone
  • 1-cyclohexyl-5-methylpyrimidine-2,4-dione
  • 1-cyclohexylthymine
  • 2,4(1h,3h)-pyrimidinedione, 1-cyclohexyl-5-methyl-
CAS Number(s)
  • 21031-74-3
InChIKey KMKDOEBFMRRNPY-UHFFFAOYSA-N
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