Butyl (2S)-2-(4-{[5-(Trifluoromethyl)-2-Pyridinyl]Oxy}Phenoxy)Propanoate

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Properties Simple | Detailed

Formula C19H20F3NO4
IUPAC Name butyl (2s)-2-[4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenoxy]propanoate
Molecular Mass 383.362 g·mol−1
Heat of Formation -1176.4 ± 16.7 kJ·mol−1
Dipole Moment 1.48 ± 1.08 D
Volume 436.4 Å 3
Surface Area 403.27 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenoxy]propanoic acid butyl ester
  • (2s)-2-[4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenoxy]propionic acid butyl ester
  • butyl (2s)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoate
  • butyl (2s)-2-[4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenoxy]propanoate
  • propanoic acid, 2-(4-((5-(trifluoromethyl)-2-pyridinyl)oxy)phenoxy)-,butyl ester, (2s)-
CAS Number(s)
  • 79241-47-7
InChIKey VAIZTNZGPYBOGF-ZDUSSCGKSA-N
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