(3E,5Z)-6-Hydroxy-2-Oxo-6-Phenyl-3,5-Hexadienoic Acid

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Properties Simple | Detailed

Formula C12H10O4
IUPAC Name (3e,5z)-6-hydroxy-2-oxo-6-phenyl-hexa-3,5-dienoic acid
Molecular Mass 218.205 g·mol−1
Heat of Formation -467.8 ± 16.7 kJ·mol−1
Dipole Moment 7.71 ± 1.08 D
Volume 257.49 Å 3
Surface Area 254.6 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy 2.07 ± eV
Point Group Symmetry C1
Synonyms
  • (2z,4e)-2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid
  • (3e,5z)-6-hydroxy-2-keto-6-phenyl-hexa-3,5-dienoic acid
  • (3e,5z)-6-hydroxy-2-oxo-6-phenyl-hexa-3,5-dienoic acid
  • (3e,5z)-6-hydroxy-2-oxo-6-phenylhexa-3,5-dienoic acid
  • 2,4-hexadienoic acid, 2-hydroxy-6-oxo-6-phenyl-
  • 2-hydroxy-6-oxo-6-(2-hydroxyphenyl)-hexa-2,4-dienoic acid
  • 2-hydroxy-6-oxo-6-phenyl-2,4-hexadienoic acid
  • 6-hydroxy-2-keto-6-phenyl-hexa-3,5-dienoic acid
  • 6-hydroxy-2-oxo-6-phenyl-hexa-3,5-dienoic acid
  • 6-hydroxy-2-oxo-6-phenylhexa-3,5-dienoic acid
  • cpd-928
  • hopda
  • hpx
CAS Number(s)
  • 50480-67-6
InChIKey YOVXRIACERVBAG-BLQYPLODSA-N
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