3,5,7,4'-Tetrahydroxy-3'-Methoxy-6-Isoprenylflavone

Molecule SVG Image

Properties Simple | Detailed

Formula C21H20O7
IUPAC Name 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-6-(3-methylbut-2-enyl)chromen-4-one
Molecular Mass 384.379 g·mol−1
Heat of Formation -992.3 ± 16.7 kJ·mol−1
Dipole Moment 4.65 ± 1.08 D
Volume 433.97 Å 3
Surface Area 378.73 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry C1
Synonyms
  • 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-6-(3-methylbut-2-enyl)chromone
  • 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-(3-methylbut-2-enyl)-4-chromenone
  • 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-(3-methylbut-2-enyl)chromen-4-one
  • gancaonin p-3'-methyl ether
  • gancaonin p-3'-methylether
  • thmif
CAS Number(s)
  • 151776-21-5
InChIKey UXTFKMCFQVSJLL-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