4-Butyl-4-Hydroxy-1,2-Diphenyl-3,5-Pyrazolidinedione

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Properties Simple | Detailed

Formula C19H20N2O3
IUPAC Name 4-butyl-4-hydroxy-1,2-diphenyl-pyrazolidine-3,5-dione
Molecular Mass 324.374 g·mol−1
Heat of Formation -226.6 ± 16.7 kJ·mol−1
Dipole Moment 2.49 ± 1.08 D
Volume 390.23 Å 3
Surface Area 333.86 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 2.62 ± eV
Point Group Symmetry C1
Synonyms
  • 3,5-pyrazolidinedione, 4-butyl-4-hydroxy-1,2-diphenyl-
  • 4-butyl-4-hydroxy-1,2-di(phenyl)pyrazolidine-3,5-dione
  • 4-butyl-4-hydroxy-1,2-di(phenyl)pyrazolidine-3,5-quinone
  • 4-hydroxyphenylbutazone
  • phenylbutazone, 4-hydroxy
CAS Number(s)
  • 16860-43-8
InChIKey VTEBWXHYBNAYKI-UHFFFAOYSA-N
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