(2S,3S)-1-[2-Methoxy-5-(Trifluoromethoxy)Benzyl]-2-Phenyl-3-Piperidinamine

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Properties Simple | Detailed

Formula C20H23F3N2O2
IUPAC Name (1r,2s,3s)-1-[[2-methoxy-5-(trifluoromethoxy)phenyl]methyl]-2-phenyl-piperidin-3-amine
Molecular Mass 380.404 g·mol−1
Heat of Formation -799.9 ± 16.7 kJ·mol−1
Dipole Moment 3.87 ± 1.08 D
Volume 442.75 Å 3
Surface Area 351.82 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -0.26 ± eV
Point Group Symmetry C1
Synonyms
  • ( )-(2s,3s)-3-(2-methoxy-5-trifluoromethoxybenzyl)amino-2- phenylpiperidine
  • (2s,3s)-1-[[2-methoxy-5-(trifluoromethoxy)phenyl]methyl]-2-phenyl-3-piperidinamine
  • (2s,3s)-1-[[2-methoxy-5-(trifluoromethoxy)phenyl]methyl]-2-phenyl-piperidin-3-amine
  • (2s,3s)-1-[[2-methoxy-5-(trifluoromethoxy)phenyl]methyl]-2-phenylpiperidin-3-amine
  • 3-piperidinamine, n-((2-methoxy-5-(trifluoromethoxy)phenyl)methyl)-2-phenyl-, (2s,3s)-
  • 3-piperidinamine, n-((2-methoxy-5-(trifluoromethoxy)phenyl)methyl)-2-phenyl-, (2s-cis)-
  • [(2s,3s)-1-[2-methoxy-5-(trifluoromethoxy)benzyl]-2-phenyl-3-piperidyl]amine
  • cp 122,721
  • cp 122721
  • cp-122,721
CAS Number(s)
  • 145742-28-5
InChIKey KDLSAUWMAZNLDZ-HKUYNNGSSA-N
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