2-(1-{(3E)-3-[6-Fluoro-2-(Trifluoromethyl)-9H-Thioxanthen-9-Ylidene]Propyl}-4-Piperidinyl)Ethanol

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Properties Simple | Detailed

Formula C24H25F4NOS
IUPAC Name 2-[1-[(3e)-3-[6-fluoro-2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]-4-piperidyl]ethanol
Molecular Mass 451.520 g·mol−1
Heat of Formation -867.8 ± 16.7 kJ·mol−1
Dipole Moment 3.20 ± 1.08 D
Volume 511.52 Å 3
Surface Area 446.98 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -1.07 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(3-(6-fluoro-2-(trifluoromethyl)thioxanthen-9-ylidene)propyl)-4-piperidineethanol
  • 2-[1-[(3e)-3-[6-fluoro-2-(trifluoromethyl)-9-thioxanthenylidene]propyl]-4-piperidinyl]ethanol
  • 2-[1-[(3e)-3-[6-fluoro-2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]-4-piperidyl]ethanol
  • 2-[1-[(3e)-3-[6-fluoro-2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]piperidin-4-yl]ethanol
  • 2-[1-[3-[6-fluoro-2-(trifluoromethyl)-9-thioxanthenylidene]propyl]-4-piperidinyl]ethanol
  • 2-[1-[3-[6-fluoro-2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]-4-piperidyl]ethanol
  • 2-[1-[3-[6-fluoro-2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]piperidin-4-yl]ethanol
  • pdsp1_000517
  • pdsp1_000618
  • pdsp1_000795
  • pdsp1_001126
  • pdsp2_000515
  • pdsp2_000615
  • pdsp2_000783
  • pdsp2_001110
  • piflutixol
CAS Number(s)
  • 54341-02-5
InChIKey CCUOZZURYIZOKX-FQJNFEMKSA-N
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