(1R)-1-[2,8-Bis(Trifluoromethyl)-4-Quinolinyl]-3-[(2-Methyl-2-Propanyl)Amino]-1-Propanol

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Properties Simple | Detailed

Formula C18H20F6N2O
IUPAC Name (1r)-1-[2,8-bis(trifluoromethyl)-4-quinolyl]-3-(tert-butylamino)propan-1-ol
Molecular Mass 394.355 g·mol−1
Heat of Formation -1403.7 ± 16.7 kJ·mol−1
Dipole Moment 7.21 ± 1.08 D
Volume 434.2 Å 3
Surface Area 340.85 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy -2.18 ± eV
Point Group Symmetry C1
Synonyms
  • (1r)-1-[2,8-bis(trifluoromethyl)-4-quinolyl]-3-(tert-butylamino)propan-1-ol
InChIKey NEZJFNMPGLCANK-CYBMUJFWSA-N
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