Pedicellin

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Properties Simple | Detailed

Formula C20H22O6
IUPAC Name (e)-1-(2,3,4,5,6-pentamethoxyphenyl)-3-phenyl-prop-2-en-1-one
Molecular Mass 358.385 g·mol−1
Heat of Formation -645.2 ± 16.7 kJ·mol−1
Dipole Moment 3.82 ± 1.08 D
Volume 426.97 Å 3
Surface Area 377.58 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 2.63 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-1-(2,3,4,5,6-pentamethoxyphenyl)-3-phenyl-prop-2-en-1-one
  • (e)-1-(2,3,4,5,6-pentamethoxyphenyl)-3-phenylprop-2-en-1-one
  • (e)-1-(pentamethoxyphenyl)-3-phenyl-2-propen-1-one
  • 1-(2,3,4,5,6-pentamethoxyphenyl)-3-phenyl-prop-2-en-1-one
  • 1-(2,3,4,5,6-pentamethoxyphenyl)-3-phenylprop-2-en-1-one
  • 2-propen-1-one, 1-(pentamethoxyphenyl)-3-phenyl-, (e)-
CAS Number(s)
  • 518-58-1
InChIKey BHTMJPHRPUKDBL-VAWYXSNFSA-N
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