(4E)-1-(2,4,5-Trihydroxy-3,6-Dimethylphenyl)-4-Hexen-1-One

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Properties Simple | Detailed

Formula C14H18O4
IUPAC Name (e)-1-(2,4,5-trihydroxy-3,6-dimethyl-phenyl)hex-4-en-1-one
Molecular Mass 250.290 g·mol−1
Heat of Formation -680.5 ± 16.7 kJ·mol−1
Dipole Moment 3.96 ± 1.08 D
Volume 311.97 Å 3
Surface Area 278.32 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-1-(2,4,5-trihydroxy-3,6-dimethyl-phenyl)hex-4-en-1-one
  • (e)-1-(2,4,5-trihydroxy-3,6-dimethylphenyl)hex-4-en-1-one
InChIKey KLQGVWIQLPTWBL-SNAWJCMRSA-N
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Elements H C O