2-Methoxy-3,5-Dimethyl-6-{(2R,4Z)-4-[(2Z)-2-Methyl-3-(4-Nitrophenyl)-2-Propen-1-Ylidene]Tetrahydro-2-Furanyl}-4H-Pyran-4-One

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Properties Simple | Detailed

Formula C22H23NO6
IUPAC Name 2-methoxy-3,5-dimethyl-6-[(2r,4z)-4-[(z)-2-methyl-3-(4-nitrophenyl)prop-2-enylidene]tetrahydrofuran-2-yl]pyran-4-one
Molecular Mass 397.421 g·mol−1
Heat of Formation -476.9 ± 16.7 kJ·mol−1
Dipole Moment 10.37 ± 1.08 D
Volume 473.32 Å 3
Surface Area 349.45 Å 2
HOMO Energy -9.02 ± 0.55 eV
LUMO Energy -1.15 ± eV
Point Group Symmetry C1
Synonyms
  • 2-methoxy-3,5-dimethyl-6-[(2r,4z)-4-[(z)-2-methyl-3-(4-nitrophenyl)prop-2-enylidene]-2-tetrahydrofuranyl]-4-pyranone
  • 2-methoxy-3,5-dimethyl-6-[(2r,4z)-4-[(z)-2-methyl-3-(4-nitrophenyl)prop-2-enylidene]oxolan-2-yl]pyran-4-one
  • 2-methoxy-3,5-dimethyl-6-[(2r,4z)-4-[(z)-2-methyl-3-(4-nitrophenyl)prop-2-enylidene]tetrahydrofuran-2-yl]pyran-4-one
InChIKey GQKXCBCSVYJUMI-WTEJLRIGSA-N
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