Uncinatone

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Properties Simple | Detailed

Formula C20H22O4
IUPAC Name (9s,11bs)-7,11-dihydroxy-3,4,9,11b-tetramethyl-1,2,8,9-tetrahydronaphtho[2,1-f]benzofuran-6-one
Molecular Mass 326.386 g·mol−1
Heat of Formation -587.1 ± 16.7 kJ·mol−1
Dipole Moment 4.96 ± 1.08 D
Volume 384.19 Å 3
Surface Area 324.64 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -0.46 ± eV
Point Group Symmetry C1
Synonyms
  • unicinatone
CAS Number(s)
  • 99624-92-7
InChIKey IQGPVLVWUUPQMQ-FVINQWEUSA-N
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Elements H C O