4-[3-(3,4-Dimethoxyphenyl)-3-(4-Fluorophenyl)-1-Oxo-2-Propenyl]Morpholine

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Properties Simple | Detailed

Formula C21H22FNO4
IUPAC Name (e)-3-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-1-morpholino-prop-2-en-1-one
Molecular Mass 371.402 g·mol−1
Heat of Formation -601.2 ± 16.7 kJ·mol−1
Dipole Moment 4.25 ± 1.08 D
Volume 443.49 Å 3
Surface Area 371.41 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy 2.33 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-3-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-1-morpholin-4-yl-prop-2-en-1-one
  • (e)-3-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-1-morpholin-4-ylprop-2-en-1-one
  • (e)-3-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-1-morpholino-prop-2-en-1-one
  • (e)-3-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-1-morpholinoprop-2-en-1-one
  • 3-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-1-morpholin-4-yl-prop-2-en-1-one
  • 3-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-1-morpholin-4-ylprop-2-en-1-one
  • 3-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-1-morpholino-prop-2-en-1-one
  • 3-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-1-morpholinoprop-2-en-1-one
InChIKey BKBSMMUEEAWFRX-NBVRZTHBSA-N
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