4,5-Dihydroxy-3-(3-Methyl-2-Buten-1-Yl)-1,2-Naphthalenedione

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Properties Simple | Detailed

Formula C15H14O4
IUPAC Name 4,5-dihydroxy-3-(3-methylbut-2-enyl)naphthalene-1,2-dione
Molecular Mass 258.269 g·mol−1
Heat of Formation -508.9 ± 16.7 kJ·mol−1
Dipole Moment 5.33 ± 1.08 D
Volume 298.07 Å 3
Surface Area 273.17 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy -1.63 ± eV
Point Group Symmetry C1
Synonyms
  • 4,5-dihydroxy-3-(3-methylbut-2-enyl)-1,2-naphthoquinone
  • 5-hydroxylapachol
InChIKey ZDNKGOAYDCAKCR-UHFFFAOYSA-N
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Elements H C O