4-((1-(3-Fluoropropyl)-4-Piperidinyl)Methoxy)Benzonitrile

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Properties Simple | Detailed

Formula C16H21FN2O
IUPAC Name 4-[[1-(3-fluoropropyl)-4-piperidyl]methoxy]benzonitrile
Molecular Mass 276.349 g·mol−1
Heat of Formation -190.8 ± 16.7 kJ·mol−1
Dipole Moment 4.78 ± 1.08 D
Volume 351.11 Å 3
Surface Area 326.95 Å 2
HOMO Energy -9.02 ± 0.55 eV
LUMO Energy -0.58 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(3-fluoropropyl)-4-(4-cyanophenoxymethyl)piperidine
  • 1-fpr-4-cnphomep
  • 4-[[1-(3-fluoropropyl)-4-piperidinyl]methoxy]benzonitrile
  • benzonitrile, 4-((1-(3-fluoropropyl)-4-piperidinyl)methoxy)-
CAS Number(s)
  • 180847-28-3
InChIKey KSMXCGCEJWKWOX-UHFFFAOYSA-N
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