(3S)-6-Hydroxy-8-Methoxy-3-Methyl-3,4-Dihydro-1,7,12(2H)-Tetraphenetrione

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Formula C20H16O5
IUPAC Name (3s)-6-hydroxy-8-methoxy-3-methyl-3,4-dihydro-2h-benzo[a]anthracene-1,7,12-trione
Molecular Mass 336.338 g·mol−1
Heat of Formation -626.2 ± 16.7 kJ·mol−1
Dipole Moment 2.71 ± 1.08 D
Volume 373.52 Å 3
Surface Area 322.56 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy -1.59 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-6-hydroxy-8-methoxy-3-methyl-3,4-dihydro-2h-benzo[a]anthracene-1,7,12-trione
  • benz(a)anthracene-1,7,12(2h)-trione, 3,4-dihydro-6-hydroxy-8-methoxy-3-methyl-, (s)-
  • hatomarubigin a
CAS Number(s)
  • 139562-86-0
InChIKey INDHOTAYTXVPSZ-VIFPVBQESA-N
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