1,5,6-Trihydroxy-3-Methoxy-4-(3-Methyl-1-Buten-2-Yl)-9H-Xanthen-9-One

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Properties Simple | Detailed

Formula C19H18O6
IUPAC Name 1,5,6-trihydroxy-3-methoxy-4-(2-methyl-1-methylene-propyl)xanthen-9-one
Molecular Mass 342.343 g·mol−1
Heat of Formation -806.7 ± 16.7 kJ·mol−1
Dipole Moment 5.21 ± 1.08 D
Volume 391.31 Å 3
Surface Area 326.32 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy -0.77 ± eV
Point Group Symmetry C1
Synonyms
  • 1,5,6-trihydroxy-3-methoxy-4-(2-methyl-1-methylenepropyl)-9-xanthenone
  • 1,5,6-trihydroxy-3-methoxy-4-(3-methylbut-1-en-2-yl)xanthen-9-one
  • 1,5,6-trihydroxy-4-(1-isopropylvinyl)-3-methoxy-xanthone
InChIKey NSYLWTGDDXBREV-UHFFFAOYSA-N
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Elements H C O