8-Methoxy-5-{[Methyl(2-Propyn-1-Yl)Amino]Methyl}-3-Phenyl-2H-Chromen-2-One

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Properties Simple | Detailed

Formula C21H19NO3
IUPAC Name 8-methoxy-5-[[methyl(prop-2-ynyl)amino]methyl]-3-phenyl-chromen-2-one
Molecular Mass 333.380 g·mol−1
Heat of Formation 55.3 ± 16.7 kJ·mol−1
Dipole Moment 6.59 ± 1.08 D
Volume 403.75 Å 3
Surface Area 352.48 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-1-benzopyran-2-one, 8-methoxy-5-((methyl-2-propynylamino)methyl)-3-phenyl-
  • 8-methoxy-3-phenyl-5-methylpropargylaminomethyl-1,2-benzopyrone
  • 8-methoxy-5-[(methyl-prop-2-ynyl-amino)methyl]-3-phenyl-chromen-2-one
  • 8-methoxy-5-[(methyl-prop-2-ynylamino)methyl]-3-phenyl-2-chromenone
  • 8-methoxy-5-[(methyl-prop-2-ynylamino)methyl]-3-phenylchromen-2-one
  • 8-methoxy-5-[(methyl-propargyl-amino)methyl]-3-phenyl-coumarin
  • fr 54
  • pargyropiranone
  • pargyropyranone
CAS Number(s)
  • 72543-53-4
InChIKey DAOPKAGAUIPYPR-UHFFFAOYSA-N
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