10-{3-[4-(2-Chloroethyl)-1-Piperazinyl]Propyl}-2-(Trifluoromethyl)-10H-Phenothiazine

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Properties Simple | Detailed

Formula C22H25ClF3N3S
IUPAC Name 10-[3-[4-(2-chloroethyl)piperazin-1-yl]propyl]-2-(trifluoromethyl)phenothiazine
Molecular Mass 455.967 g·mol−1
Heat of Formation -489.8 ± 16.7 kJ·mol−1
Dipole Moment 6.07 ± 1.08 D
Volume 510.72 Å 3
Surface Area 393.34 Å 2
HOMO Energy -8.01 ± 0.55 eV
LUMO Energy -0.82 ± eV
Point Group Symmetry C1
Synonyms
  • 10-[3-[4-(2-chloroethyl)-1-piperazinyl]propyl]-2-(trifluoromethyl)phenothiazine
  • 10h-phenothiazine, 10-(3-(4-(2-chloroethyl)-1-piperazinyl)propyl)-2-(trifluoromethyl)-
  • ao-365/15161001
  • fluphenazine-n-2-chloroethane
  • fluphenazine-n-mustard
  • hsci1_000317
  • n-chloroethyl-fluphenazine
  • sk&f 7172-a2
  • skf 7171a
  • skf 7172-a2
CAS Number(s)
  • 83016-35-7
InChIKey WHVNGICQKYBDDP-UHFFFAOYSA-N
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Elements C F H Cl N S