Butyl Nicotinate

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Properties Simple | Detailed

Formula C10H13NO2
IUPAC Name butyl pyridine-3-carboxylate
Molecular Mass 179.216 g·mol−1
Heat of Formation -290.3 ± 16.7 kJ·mol−1
Dipole Moment 0.20 ± 1.08 D
Volume 226.71 Å 3
Surface Area 227.33 Å 2
HOMO Energy -10.54 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry Cs
Synonyms
  • 3-pyridinecarboxylic acid butyl ester
  • 3-pyridinecarboxylic acid, butyl ester
  • ba 2674
  • n-butyl nicotinate
  • n-butyl-nicotinate
  • nicotinic acid butyl ester
  • nicotinic acid, butyl ester
CAS Number(s)
  • 6938-06-3
  • 123574-73-2
  • 93-93-6
InChIKey DQULIMIQTCDUAN-UHFFFAOYSA-N
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