N-Methylspiperone

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Properties Simple | Detailed

Formula C24H28FN3O2
IUPAC Name (1r)-8-[4-(4-fluorophenyl)-4-oxo-butyl]-3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Molecular Mass 409.496 g·mol−1
Heat of Formation -317.9 ± 16.7 kJ·mol−1
Dipole Moment 3.71 ± 1.08 D
Volume 500.15 Å 3
Surface Area 370.05 Å 2
HOMO Energy -8.47 ± 0.55 eV
LUMO Energy -0.34 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3,8-triazaspiro(4.5)decan-4-one, 8-(4-(4-fluorophenyl)-4-oxobutyl)-3-methyl-1-phenyl-
  • 3-n-methylspiperone
  • 8-(4-(4-fluorophenyl)-4-oxobutyl)-3-methyl-1-phenyl-1,3,8-triazaspiro(4.5)decan-4-one
  • 8-[4-(4-fluorophenyl)-4-keto-butyl]-3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
  • 8-[4-(4-fluorophenyl)-4-oxo-butyl]-3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
  • 8-[4-(4-fluorophenyl)-4-oxobutyl]-3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
  • n-methylspiroperidol
  • pdsp1_000043
  • pdsp2_000043
CAS Number(s)
  • 87539-19-3
InChIKey QHJLPOSPWKZACG-UHFFFAOYSA-N
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