2-[(3R)-7,8-Dimethoxy-3,4-Dihydro-2H-Chromen-3-Yl]-6-Hydroxy-1,4-Benzoquinone

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Properties Simple | Detailed

Formula C17H16O6
IUPAC Name 2-[(3r)-7,8-dimethoxychroman-3-yl]-6-hydroxy-1,4-benzoquinone
Molecular Mass 316.305 g·mol−1
Heat of Formation -694.6 ± 16.7 kJ·mol−1
Dipole Moment 2.27 ± 1.08 D
Volume 354.76 Å 3
Surface Area 317.61 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy -1.98 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-astragaluquinone
  • 1-(7,8-dimethoxybenzopyranyl)-4-hydroxybenzoquinone
  • 2,5-cyclohexadiene-1,4-dione, 2-(3,4-dihydro-7,8-dimethoxy-2h-1-benzopyran-3-yl)-6-hydroxy-, (r)-
  • 2-[(3r)-7,8-dimethoxy-3-chromanyl]-6-hydroxy-1,4-benzoquinone
  • 2-[(3r)-7,8-dimethoxychroman-3-yl]-6-hydroxy-1,4-benzoquinone
  • 2-[(3r)-7,8-dimethoxychroman-3-yl]-6-hydroxy-cyclohexa-2,5-diene-1,4-dione
  • 2-[(3r)-7,8-dimethoxychroman-3-yl]-6-hydroxy-p-benzoquinone
  • 2-[(3r)-7,8-dimethoxychroman-3-yl]-6-hydroxycyclohexa-2,5-diene-1,4-dione
  • astragaluquinone
CAS Number(s)
  • 158991-20-9
InChIKey ZPNCZRGNATWPGL-JTQLQIEISA-N
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