1,7,9,11-Tetrahydroxy-3-Pentylbenzo[A]Tetracene-8,13-Dione

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Properties Simple | Detailed

Formula C27H22O6
IUPAC Name 1,7,9,11-tetrahydroxy-3-pentyl-benzo[a]tetracene-8,13-dione
Molecular Mass 442.460 g·mol−1
Heat of Formation -819.9 ± 16.7 kJ·mol−1
Dipole Moment 3.00 ± 1.08 D
Volume 495.83 Å 3
Surface Area 436.44 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy 1.42 ± eV
Point Group Symmetry C1
Synonyms
  • 3-pentyl-1,7,9,11-tetrahydroxybenzo(a)naphthacene-8,13-dione
  • 8,13-dihydro-1,7,9,11-tetrahydroxy-8,13-dioxo-3-pentylbenzo(a)naphthacene
  • benzo(a)naphthacene-8,13-dione, 1,7,9,11-tetrahydroxy-3-pentyl-
  • benzo(a)naphthacene-8,13-dione, 3-pentyl-1,7,9,11-tetrahydroxy-
  • bequinostatin d
CAS Number(s)
  • 152175-75-2
InChIKey KQPKOQPRDHCAAB-UHFFFAOYSA-N
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