(3R)-9,10-Dihydroxy-7-Methoxy-3-Methyl-3,4-Dihydro-1H-Benzo[G]Isochromen-1-One

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Properties Simple | Detailed

Formula C15H14O5
IUPAC Name (3r)-9,10-dihydroxy-7-methoxy-3-methyl-3,4-dihydrobenzo[g]isochromen-1-one
Molecular Mass 274.269 g·mol−1
Heat of Formation -760.6 ± 16.7 kJ·mol−1
Dipole Moment 7.43 ± 1.08 D
Volume 302.43 Å 3
Surface Area 278.33 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-9,10-dihydroxy-7-methoxy-3-methyl-3,4-dihydrobenzo[g]isochromen-1-one
  • semivioxanthin
CAS Number(s)
  • 70477-26-8
InChIKey BWNCKEBBYADFPQ-SSDOTTSWSA-N
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