9-(1,3-Benzodioxol-4-Yl)-1-(2,6-Dihydroxyphenyl)-1-Nonanone

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Properties Simple | Detailed

Formula C22H26O5
IUPAC Name 9-(1,3-benzodioxol-4-yl)-1-(2,6-dihydroxyphenyl)nonan-1-one
Molecular Mass 370.439 g·mol−1
Heat of Formation -776.6 ± 16.7 kJ·mol−1
Dipole Moment 2.91 ± 1.08 D
Volume 455.35 Å 3
Surface Area 338.27 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy -0.22 ± eV
Point Group Symmetry C1
Synonyms
  • malabaricone d
InChIKey QGSBUHYCKCGXLU-UHFFFAOYSA-N
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Elements H C O