Coumesterol

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Properties Simple | Detailed

Formula C15H9O5+
IUPAC Name 3,9-dihydroxybenzofuro[3,2-c]chromen-6-one
Molecular Mass 269.229 g·mol−1
Heat of Formation -539.9 ± 16.7 kJ·mol−1
Dipole Moment 3.91 ± 1.08 D
Volume 281.29 Å 3
Surface Area 261.56 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -1.60 ± eV
Point Group Symmetry Cs
Synonyms
  • 3,9-dihydroxy-6-benzofurano[3,2-c]chromenone
  • 3,9-dihydroxy-6h-[1]benzofuro[3,2-c]chromen-6-one
  • 3,9-dihydroxy-6h-benzofuro(3,2-c)(1)benzopyran-6-one
  • 3,9-dihydroxybenzofurano[3,2-c]chromen-6-one
  • 3-benzofurancarboxylic acid, 2-(2,4-dihydroxyphenyl)-6-hydroxy-, .delta.-lactone
  • 3-benzofurancarboxylic acid, 2-(2,4-dihydroxyphenyl)-6-hydroxy-, delta-lactone (6ci)
  • 6h-benzofuro(3,2-c)(1)benzopyran-6-one, 3,9-dihydroxy-
  • 6h-benzofuro[3,2-c][1]benzopyran-6-one, 3,9-dihydroxy-
  • 7,12-dihydroxycoumestan
  • coumestrol
  • cumoesterol
  • cumoestrol
  • cumostrol
  • oprea1_222511
  • s00280
  • smp2_000163
CAS Number(s)
  • 479-13-0
InChIKey ZZIALNLLNHEQPJ-UHFFFAOYSA-N
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