(2E,4Z)-5-(1,3-Benzodioxol-5-Yl)-N-(2,2-Dimethyl-3-Oxobutyl)-2,4-Pentadienamide

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Properties Simple | Detailed

Formula C18H21NO4
IUPAC Name (2e,4z)-5-(1,3-benzodioxol-5-yl)-n-(2,2-dimethyl-3-oxo-butyl)penta-2,4-dienamide
Molecular Mass 315.364 g·mol−1
Heat of Formation -479.0 ± 16.7 kJ·mol−1
Dipole Moment 3.41 ± 1.08 D
Volume 392.41 Å 3
Surface Area 345.83 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy -0.78 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,4z)-5-(1,3-benzodioxol-5-yl)-n-(2,2-dimethyl-3-oxo-butyl)penta-2,4-dienamide
  • (2e,4z)-5-(1,3-benzodioxol-5-yl)-n-(2,2-dimethyl-3-oxobutyl)penta-2,4-dienamide
  • (2e,4z)-5-(1,3-benzodioxol-5-yl)-n-(3-keto-2,2-dimethyl-butyl)penta-2,4-dienamide
InChIKey ZTYFYHPELCCIEN-XGXWUAJZSA-N
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