Methyl 2-Difluoromethyl-5-(4,5-Dihydro-1,3-Thiazol-2-Yl)-4-Isobutyl-6-Trifluoromethylnicotinate

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Properties Simple | Detailed

Formula C16H17F5N2O2S
IUPAC Name methyl 2-(difluoromethyl)-5-(4,5-dihydrothiazol-2-yl)-4-isobutyl-6-(trifluoromethyl)pyridine-3-carboxylate
Molecular Mass 396.375 g·mol−1
Heat of Formation -1276.0 ± 16.7 kJ·mol−1
Dipole Moment 5.97 ± 1.08 D
Volume 422.29 Å 3
Surface Area 344.05 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy -1.71 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(difluoromethyl)-5-(4,5-dihydrothiazol-2-yl)-4-isobutyl-6-(trifluoromethyl)-3-pyridinecarboxylic acid methyl ester
  • 2-(difluoromethyl)-5-(4,5-dihydrothiazol-2-yl)-4-isobutyl-6-(trifluoromethyl)nicotinic acid methyl ester
  • 3-pyridinecarboxylic acid, 2-(difluoromethyl)-5-(4,5-dihydro-2-thiazolyl)-4-(2-methylpropyl)-6-(trifluoromethyl)-, methyl ester
  • mandate
  • methyl 2-(difluoromethyl)-5-(4,5-dihydro-1,3-thiazol-2-yl)-4-(2-methylpropyl)-6-(trifluoromethyl)pyridine-3-carboxylate
  • methyl 2-(difluoromethyl)-5-(4,5-dihydro-1,3-thiazol-2-yl)-4-isobutyl-6-(trifluoromethyl)nicotinate
  • methyl 2-(difluoromethyl)-5-(4,5-dihydro-2-thiazolyl)-4-(2-methylpropyl)-6-(trifluoromethyl)-3-pyridinecarboxylate
  • mon 13200
  • mon 13211
  • thiazophyr
  • thiazopyr
  • visor
CAS Number(s)
  • 147172-37-0
  • 117718-60-2
  • 128606-56-4
InChIKey YIJZJEYQBAAWRJ-UHFFFAOYSA-N
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