2-{[2-(4-Chlorophenoxy)-2-Methylpropanoyl]Oxy}-1,3-Propanediyl Dinicotinate

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Properties Simple | Detailed

Formula C25H23ClN2O7
IUPAC Name [2-[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxy-3-(2,3-dihydropyridin-2-ylium-3-ide-5-carbonyloxy)propyl] 2,3-dihydropyridin-2-ylium-3-ide-5-carboxylate
Molecular Mass 498.912 g·mol−1
Heat of Formation -0.5 ± 16.7 kJ·mol−1
Dipole Moment 2.33 ± 1.08 D
Volume 551.65 Å 3
Surface Area 398.47 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy -1.68 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(p-chlorophenoxy)-2-methylpropionic acid ester with 1,3-dinicotininoyloxy-2-propanol
  • 3-pyridinecarboxylic acid [2-[2-(4-chlorophenoxy)-2-methyl-1-oxopropoxy]-3-[oxo-(3-pyridyl)methoxy]propyl] ester
  • 3-pyridinecarboxylic acid, 2-(2-(4-chlorophenoxy)-2-methyl-1-oxopropoxy)-1,3-propanediyl ester
  • [2-[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxy-3-pyridin-3-ylcarbonyloxy-propyl] pyridine-3-carboxylate
  • [2-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-3-(pyridine-3-carbonyloxy)propyl] pyridine-3-carboxylate
  • binifibrate
  • binifibrato
  • biniwas
  • nicotinic acid [2-[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxy-3-(pyridine-3-carbonyloxy)propyl] ester
  • wac 104
  • wac-104
CAS Number(s)
  • 69047-39-8
InChIKey BFYRHDVAEJIBON-UHFFFAOYSA-N
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Elements H C N O Cl