Iso-Alvaxanthone

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Properties Simple | Detailed

Formula C23H25O6+
IUPAC Name 2-(1,1-dimethylallyl)-1,3,5,6-tetrahydroxy-7-(3-methylbut-2-enyl)xanthen-9-one
Molecular Mass 397.441 g·mol−1
Heat of Formation -885.1 ± 16.7 kJ·mol−1
Dipole Moment 4.25 ± 1.08 D
Volume 458.97 Å 3
Surface Area 395.09 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3,5,6-tetrahydroxy-2-(2-methylbut-3-en-2-yl)-7-(3-methylbut-2-enyl)xanthen-9-one
  • 2-(1,1-dimethylprop-2-enyl)-1,3,5,6-tetrahydroxy-7-(3-methylbut-2-enyl)-9-xanthenone
  • 2-(1,1-dimethylprop-2-enyl)-1,3,5,6-tetrahydroxy-7-(3-methylbut-2-enyl)xanthen-9-one
  • 2-(1,1-dimethylprop-2-enyl)-1,3,5,6-tetrahydroxy-7-(3-methylbut-2-enyl)xanthone
InChIKey HSGGSJBRVQFVGH-UHFFFAOYSA-N
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