4,5,7-Trihydroxy-1,2-Naphthalenedione

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Properties Simple | Detailed

Formula C10H6O5
IUPAC Name 4,5,7-trihydroxynaphthalene-1,2-dione
Molecular Mass 206.152 g·mol−1
Heat of Formation -657.5 ± 16.7 kJ·mol−1
Dipole Moment 6.10 ± 1.08 D
Volume 211.92 Å 3
Surface Area 203.68 Å 2
HOMO Energy -9.55 ± 0.55 eV
LUMO Energy -1.73 ± eV
Point Group Symmetry C1
Synonyms
  • 1,4-naphthalenedione, 2,5,7-trihydroxy-
  • 2,5,7-trihydroxynaphthoquinone
  • 4,5,7-trihydroxy-1,2-naphthoquinone
  • flaviolin
CAS Number(s)
  • 479-05-0
InChIKey XNPCAGMCQDGQKK-UHFFFAOYSA-N
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DOI
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