(2E)-3-(3,4-Dihydroxy-2-Methoxyphenyl)-1-[4-Hydroxy-3-(3-Methyl-2-Buten-1-Yl)Phenyl]-2-Propen-1-One

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Properties Simple | Detailed

Formula C21H22O5
IUPAC Name (e)-3-(3,4-dihydroxy-2-methoxy-phenyl)-1-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]prop-2-en-1-one
Molecular Mass 354.396 g·mol−1
Heat of Formation -647.2 ± 16.7 kJ·mol−1
Dipole Moment 0.96 ± 1.08 D
Volume 434.99 Å 3
Surface Area 360.63 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy 2.42 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-3-(3,4-dihydroxy-2-methoxy-phenyl)-1-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]prop-2-en-1-one
  • (e)-3-(3,4-dihydroxy-2-methoxyphenyl)-1-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]prop-2-en-1-one
InChIKey RETRVWFVEFCGOK-RMKNXTFCSA-N
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Elements H C O