5-Hydroxy-3-(4-Hydroxyphenyl)-8,8-Dimethyl-6-(3-Methyl-2-Buten-1-Yl)-4H,8H-Pyrano[2,3-F]Chromen-4-One

Molecule SVG Image

Properties Simple | Detailed

Formula C25H24O5
IUPAC Name 5-hydroxy-3-(4-hydroxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-enyl)pyrano[2,3-h]chromen-4-one
Molecular Mass 404.455 g·mol−1
Heat of Formation -654.1 ± 16.7 kJ·mol−1
Dipole Moment 4.95 ± 1.08 D
Volume 483.44 Å 3
Surface Area 405.79 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.61 ± eV
Point Group Symmetry C1
Synonyms
  • 4h,8h-benzo(1,2-b:3,4-b')dipyran-4-one, 5-hydroxy-3-(p-hydroxyphenyl)-8,8-dimethyl-6-(3-methyl-2-butenyl)- (8ci)
  • 4h,8h-benzo[1,2-b:3,4-b']dipyran-4-one, 5-hydroxy-3-(4-hydroxyphenyl)-8,8-dimethyl-6-(3-methyl-2-butenyl)-
  • 4h,8h-benzo[1,2-b:3,4-b']dipyran-4-one, 5-hydroxy-3-(p-hydroxyphenyl)-8,8-dimethyl-6-(3-methyl-2-butenyl)-
  • 5-hydroxy-3-(4-hydroxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-enyl)-4-pyrano[6,5-h]chromenone
  • 5-hydroxy-3-(4-hydroxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-enyl)pyrano[6,5-h]chromen-4-one
  • acon1_002463
  • bas 00015472
  • megxp0_001415
  • oprea1_003228
  • oprea1_066678
  • osajin
  • sdccgmls-0066875.p001
CAS Number(s)
  • 482-53-1
InChIKey DCTLJGWMHPGCOS-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O