1-(2-Pyrimidyl)-4-(3,4-Dihydroxybenzyl)Piperazine

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Properties Simple | Detailed

Formula C15H18N4O2
IUPAC Name 4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]benzene-1,2-diol
Molecular Mass 286.329 g·mol−1
Heat of Formation -64.3 ± 16.7 kJ·mol−1
Dipole Moment 1.85 ± 1.08 D
Volume 342.41 Å 3
Surface Area 308.83 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy -0.01 ± eV
Point Group Symmetry C1
Synonyms
  • 4-((4-(2-pyrimidinyl)-1-piperazinyl)methyl)-1,2-benzenediol
  • 4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]pyrocatechol
  • 4-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]benzene-1,2-diol
  • s 584
  • s-584
InChIKey KASPTNXQKINYTJ-UHFFFAOYSA-N
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