5-(Aminomethyl)-6-Isobutyl-2-Methyl-4-(4-Methylphenyl)Nicotinic Acid

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Properties Simple | Detailed

Formula C19H24N2O2
IUPAC Name 5-(aminomethyl)-6-isobutyl-2-methyl-4-(p-tolyl)pyridine-3-carboxylic acid
Molecular Mass 312.406 g·mol−1
Heat of Formation -338.4 ± 16.7 kJ·mol−1
Dipole Moment 1.75 ± 1.08 D
Volume 399.68 Å 3
Surface Area 340.09 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy -0.94 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(2-methylpropyl)pyridine-3-carboxylic acid
  • 5-(aminomethyl)-6-isobutyl-2-methyl-4-(4-methylphenyl)-3-pyridinecarboxylic acid
  • 5-(aminomethyl)-6-isobutyl-2-methyl-4-(4-methylphenyl)pyridine-3-carboxylic acid
InChIKey NOAXOYPKZRNSHN-UHFFFAOYSA-N
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