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

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Properties Simple | Detailed

Formula C6H6O4
IUPAC Name (3z,5e)-6-hydroxy-2-oxo-hexa-3,5-dienoic acid
Molecular Mass 142.109 g·mol−1
Heat of Formation -565.0 ± 16.7 kJ·mol−1
Dipole Moment 3.22 ± 1.08 D
Volume 164.05 Å 3
Surface Area 172.58 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C1
Synonyms
  • (3z,5e)-6-hydroxy-2-keto-hexa-3,5-dienoic acid
  • (3z,5e)-6-hydroxy-2-oxo-hexa-3,5-dienoic acid
  • (3z,5e)-6-hydroxy-2-oxohexa-3,5-dienoic acid
  • 2-hydroxy-6-oxo-2,4-hexadienoic acid
  • 2-hydroxy-6-oxohexa-2,4-dienoate semialdehyde
  • hydroxymuconic semialdehyde
InChIKey MTOBWJUHQXQURZ-HSFFGMMNSA-N
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Elements H C O