3-Propyl-1H-Pyrazolo(2,3-B)Isoquinolin-9-One

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Properties Simple | Detailed

Formula C14H14N2O
IUPAC Name 3-propyl-1h-pyrazolo[1,5-b]isoquinolin-9-one
Molecular Mass 226.274 g·mol−1
Heat of Formation 2372.5 ± 16.7 kJ·mol−1
Dipole Moment 4.90 ± 1.08 D
Volume 246.25 Å 3
Surface Area 236.56 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy -1.24 ± eV
Point Group Symmetry Cs
Synonyms
  • 3-propyl-1h-pyrazolo(2,3-b)isoquinolin-9-one
  • 3-propyl-1h-pyrazolo[1,5-b]isoquinolin-9-one
  • antibiotic aphe 2
  • aphe-2
  • pyrazolo(1,5-b)isoquinolin-9(1h)-one, 3-propyl-
CAS Number(s)
  • 146426-36-0
InChIKey UEBKDIQNDUBHCD-UHFFFAOYSA-N
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