Psoralidin

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Properties Simple | Detailed

Formula C20H16O5
IUPAC Name 3,9-dihydroxy-2-(3-methylbut-2-enyl)benzofuro[3,2-c]chromen-6-one
Molecular Mass 336.338 g·mol−1
Heat of Formation -583.6 ± 16.7 kJ·mol−1
Dipole Moment 7.97 ± 1.08 D
Volume 379.19 Å 3
Surface Area 343.6 Å 2
HOMO Energy -8.64 ± 0.55 eV
LUMO Energy -1.17 ± eV
Point Group Symmetry C1
Synonyms
  • 3,9-dihydroxy-2-(3-methyl-2-butenyl)-6h-benzofuro(3,2-c)(1)benzopyran-6-one
  • 3,9-dihydroxy-2-(3-methylbut-2-enyl)-6-benzofurano[3,2-c]chromenone
  • 3,9-dihydroxy-2-(3-methylbut-2-enyl)benzofurano[3,2-c]chromen-6-one
  • 6h-benzofuro(3,2-c)(1)benzopyran-6-one, 3,9-dihydroxy-2-(3-methyl-2-butenyl)-
CAS Number(s)
  • 18642-23-4
InChIKey YABIJLLNNFURIJ-UHFFFAOYSA-N
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