1-Ethyl-7-Phenylpyrrolo[1,2-A]Pyrimidin-4(1H)-One

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Properties Simple | Detailed

Formula C15H14N2O
IUPAC Name 1-ethyl-7-phenyl-pyrrolo[1,2-a]pyrimidine-1,5-diium-4-one
Molecular Mass 238.284 g·mol−1
Heat of Formation 94.5 ± 16.7 kJ·mol−1
Dipole Moment 6.29 ± 1.08 D
Volume 289.29 Å 3
Surface Area 268.38 Å 2
HOMO Energy -8.32 ± 0.55 eV
LUMO Energy 2.53 ± eV
Point Group Symmetry C1
Synonyms
  • 1,4-dihydro-1-ethyl-7-phenylpyrrol(1,2-a)-pyrimidine-4-one
  • 1,4-dihydro-1-ethyl-7-phenylpyrrolo(1,2-a)pyrimidin-4-one
  • 1-ethyl-7-phenyl-4-pyrrolo[2,1-b]pyrimidinone
  • 1-ethyl-7-phenyl-pyrrolo[2,1-b]pyrimidin-4-one
  • fpp 129
  • pyrrolo(1,2-a)pyrimidin-4(1h)-one, 1-ethyl-7-phenyl-
  • pyrrolo(1,2-a)pyrimidin-4-one, 1,4-dihydro-1-ethyl-7-phenyl-
  • v 33
CAS Number(s)
  • 112466-13-4
InChIKey XPOMIEQGRUAZPP-UHFFFAOYSA-N
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