Tanshinon I

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Properties Simple | Detailed

Formula C18H12O3
IUPAC Name 1,6-dimethylnaphtho[1,2-g]benzofuran-10,11-dione
Molecular Mass 276.286 g·mol−1
Heat of Formation -134.0 ± 16.7 kJ·mol−1
Dipole Moment 5.19 ± 1.08 D
Volume 309.62 Å 3
Surface Area 279.11 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy -1.81 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,6-dimethylnaphtho[1,2-g][1]benzoxole-10,11-dione
  • 1,6-dimethylnaphtho[1,2-g]benzofuran-10,11-quinone
  • 1,6-dimethylphenanthro(1,2-b)furan-10,11-dione
  • bb_nc-1754
  • phenanthro(1,2-b)furan-10,11-dione, 1,6-dimethyl-
  • phenanthro[1,2-b]furan-10,11-dione, 1,6-dimethyl-
  • tanshinone a
CAS Number(s)
  • 568-73-0
InChIKey AIGAZQPHXLWMOJ-UHFFFAOYSA-N
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