6-(1,4-Dihydro-3-Methyl-1,4-Dioxo-2-Naphthalenyl)-4-Methyl- 4-Hexenoic Acid

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Properties Simple | Detailed

Formula C18H18O4
IUPAC Name (z)-4-methyl-6-(3-methyl-1,4-dioxo-2-naphthyl)hex-4-enoic acid
Molecular Mass 298.333 g·mol−1
Heat of Formation -566.4 ± 16.7 kJ·mol−1
Dipole Moment 2.12 ± 1.08 D
Volume 360.79 Å 3
Surface Area 320.72 Å 2
HOMO Energy -9.72 ± 0.55 eV
LUMO Energy 1.44 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-4-methyl-6-(3-methyl-1,4-dioxo-2-naphthyl)hex-4-enoic acid
  • (z)-4-methyl-6-(3-methyl-1,4-dioxo-naphthalen-2-yl)hex-4-enoic acid
  • (z)-4-methyl-6-(3-methyl-1,4-dioxonaphthalen-2-yl)hex-4-enoic acid
  • (z)-6-(1,4-diketo-3-methyl-2-naphthyl)-4-methyl-hex-4-enoic acid
InChIKey BCNIZSHMXASUGF-XFFZJAGNSA-N
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Elements H C O