5-Ethyl-5-(4-Hydroxy-2-Pentanyl)-2,4,6(1H,3H,5H)-Pyrimidinetrione

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Properties Simple | Detailed

Formula C11H18N2O4
IUPAC Name 5-ethyl-5-[(1r,3r)-3-hydroxy-1-methyl-butyl]hexahydropyrimidine-2,4,6-trione
Molecular Mass 242.272 g·mol−1
Heat of Formation -864.7 ± 16.7 kJ·mol−1
Dipole Moment 2.58 ± 1.08 D
Volume 290.93 Å 3
Surface Area 252.31 Å 2
HOMO Energy -10.76 ± 0.55 eV
LUMO Energy -0.46 ± eV
Point Group Symmetry C1
InChIKey XYOPMDJVSWQZTM-RNFRBKRXSA-N
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