(S)-[2,8-Bis(Trifluoromethyl)-4-Quinolinyl][(2S)-2-Piperidinyl]Methanol

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Properties Simple | Detailed

Formula C17H16F6N2O
IUPAC Name (s)-[2,8-bis(trifluoromethyl)-4-quinolyl]-[(2s)-2-piperidyl]methanol
Molecular Mass 378.312 g·mol−1
Heat of Formation -1340.6 ± 16.7 kJ·mol−1
Dipole Moment 9.64 ± 1.08 D
Volume 390.83 Å 3
Surface Area 334.82 Å 2
HOMO Energy -9.86 ± 0.55 eV
LUMO Energy -1.81 ± eV
Point Group Symmetry C1
Synonyms
  • (+)-threo-4-quinolinemethanol, .alpha.-2-piperidinyl-2,8-bis(trifluoromethyl)-, (11s, 2's)-
  • (+)-threo-mefloquine
  • (s)-[2,8-bis(trifluoromethyl)-4-quinolyl]-[(2s)-2-piperidinyl]methanol
  • (s)-[2,8-bis(trifluoromethyl)-4-quinolyl]-[(2s)-2-piperidyl]methanol
  • (s)-[2,8-bis(trifluoromethyl)quinolin-4-yl]-[(2s)-piperidin-2-yl]methanol
  • rti1173-1-1
CAS Number(s)
  • 51744-85-5
InChIKey XEEQGYMUWCZPDN-WFASDCNBSA-N
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