4-[(2E)-3,7-Dimethyl-2,6-Octadien-1-Yl]-3,5-Dihydroxy-6-(3-Methyl-2-Buten-1-Yl)-1,2-Benzoquinone

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Properties Simple | Detailed

Formula C21H28O4
IUPAC Name 4-[(2e)-3,7-dimethylocta-2,6-dienyl]-3,5-dihydroxy-6-(3-methylbut-2-enyl)-1,2-benzoquinone
Molecular Mass 344.445 g·mol−1
Heat of Formation -597.1 ± 16.7 kJ·mol−1
Dipole Moment 5.24 ± 1.08 D
Volume 458.38 Å 3
Surface Area 361.8 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -1.34 ± eV
Point Group Symmetry C1
Synonyms
  • 2,5-cyclohexadiene-1,4-dione, 2-[(2e)-3,7-dimethyl-2,6-octadienyl]-3,5-dihydroxy-6-(3-methyl-2-butenyl)-
  • 2,6-dihydroxyl-3-geranyl-5-isoprenyl-2,5-dihexadiene-1,4-dione
  • 2-(3,7-dimethyl-octa-2,6-dienyl)-3,5-dihydroxy-6-(3-methyl-but-2-enyl)-[1,4]benzoquinone
  • 2-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-3,5-dihydroxy-6-(3-methylbut-2-en-1-yl)benzo-1,4-quinone
  • 4-[(2e)-3,7-dimethylocta-2,6-dienyl]-3,5-dihydroxy-6-(3-methylbut-2-enyl)-1,2-benzoquinone
  • 4-[(2e)-3,7-dimethylocta-2,6-dienyl]-3,5-dihydroxy-6-(3-methylbut-2-enyl)-o-benzoquinone
  • 4-[(2e)-3,7-dimethylocta-2,6-dienyl]-3,5-dihydroxy-6-(3-methylbut-2-enyl)cyclohexa-3,5-diene-1,2-dione
  • erectquione a
InChIKey OXDKRQBRJWYFPA-XNTDXEJSSA-N
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