4-[(E)-2-{3,5-Dihydroxy-4-[(1E)-3-Methyl-1-Buten-1-Yl]Phenyl}Vinyl]-1,2-Benzenediol

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Properties Simple | Detailed

Formula C19H20O4
IUPAC Name 5-[(e)-2-(3,4-dihydroxyphenyl)vinyl]-2-[(e)-3-methylbut-1-enyl]benzene-1,3-diol
Molecular Mass 312.360 g·mol−1
Heat of Formation -518.1 ± 16.7 kJ·mol−1
Dipole Moment 3.58 ± 1.08 D
Volume 382.46 Å 3
Surface Area 356.26 Å 2
HOMO Energy -8.55 ± 0.55 eV
LUMO Energy 2.34 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[(e)-2-(3,4-dihydroxyphenyl)ethenyl]-2-[(e)-3-methylbut-1-enyl]benzene-1,3-diol
  • 5-[(e)-2-(3,4-dihydroxyphenyl)vinyl]-2-[(e)-3-methylbut-1-enyl]benzene-1,3-diol
  • 5-[(e)-2-(3,4-dihydroxyphenyl)vinyl]-2-[(e)-3-methylbut-1-enyl]resorcinol
InChIKey YOWZUITYQFPEGQ-JLVHPEPXSA-N
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