2-{4-[Butyl(3-Chloro-4,5-Dimethoxybenzyl)Amino]Phenyl}-1,1,1,3,3,3-Hexafluoro-2-Propanol

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Formula C22H24ClF6NO3
IUPAC Name 2-[4-[butyl-[(3-chloro-4,5-dimethoxy-phenyl)methyl]amino]phenyl]-1,1,1,3,3,3-hexafluoro-propan-2-ol
Molecular Mass 499.874 g·mol−1
Heat of Formation -1751.5 ± 16.7 kJ·mol−1
Dipole Moment 3.49 ± 1.08 D
Volume 543.26 Å 3
Surface Area 434.11 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy 2.44 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[4-[butyl-(3-chloro-4,5-dimethoxy-benzyl)amino]phenyl]-1,1,1,3,3,3-hexafluoro-propan-2-ol
  • 2-[4-[butyl-[(3-chloro-4,5-dimethoxyphenyl)methyl]amino]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
InChIKey QKFWYOZIIUVZRC-UHFFFAOYSA-N
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