(2E,4E)-5-(6-Methoxy-1,3-Benzodioxol-5-Yl)-1-(1-Piperidinyl)-2,4-Pentadien-1-One

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Properties Simple | Detailed

Formula C18H21NO4
IUPAC Name (2e,4e)-5-(6-methoxy-1,3-benzodioxol-5-yl)-1-(1-piperidyl)penta-2,4-dien-1-one
Molecular Mass 315.364 g·mol−1
Heat of Formation -425.3 ± 16.7 kJ·mol−1
Dipole Moment 5.44 ± 1.08 D
Volume 383.85 Å 3
Surface Area 346.3 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -1.15 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,4e)-5-(6-methoxy-1,3-benzodioxol-5-yl)-1-(1-piperidyl)penta-2,4-dien-1-one
  • (2e,4e)-5-(6-methoxy-1,3-benzodioxol-5-yl)-1-piperidin-1-yl-penta-2,4-dien-1-one
  • (2e,4e)-5-(6-methoxy-1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one
  • (2e,4e)-5-(6-methoxy-1,3-benzodioxol-5-yl)-1-piperidino-penta-2,4-dien-1-one
  • piperidine, 1-(5-(6-methoxy-1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)-, (e,e)-
  • wisanine
CAS Number(s)
  • 61756-56-7
InChIKey NCSVIEQJHMEYFR-FCXRPNKRSA-N
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