(3Z,5E)-6-(3,4-Dihydroxyphenyl)-4-Hydroxy-3,5-Hexadien-2-One

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Properties Simple | Detailed

Formula C12H12O4
IUPAC Name (3z,5e)-6-(3,4-dihydroxyphenyl)-4-hydroxy-hexa-3,5-dien-2-one
Molecular Mass 220.221 g·mol−1
Heat of Formation -558.4 ± 16.7 kJ·mol−1
Dipole Moment 3.15 ± 1.08 D
Volume 256.07 Å 3
Surface Area 254.52 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
Synonyms
  • (3z,5e)-6-(3,4-dihydroxyphenyl)-4-hydroxy-hexa-3,5-dien-2-one
  • (3z,5e)-6-(3,4-dihydroxyphenyl)-4-hydroxyhexa-3,5-dien-2-one
InChIKey QDVIEIMMEUCFMW-QXYPORFMSA-N
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