Pyridine-3-Carbonitrile, 2-Hydroxy-4-Methyl-6-Oxo-1-Phenethyl-1,6-Dihydro-

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Properties Simple | Detailed

Formula C15H14N2O2
IUPAC Name 2-hydroxy-4-methyl-6-oxo-1-(2-phenylethyl)pyridine-3-carbonitrile
Molecular Mass 254.284 g·mol−1
Heat of Formation -126.4 ± 16.7 kJ·mol−1
Dipole Moment 1.21 ± 1.08 D
Volume 311.89 Å 3
Surface Area 284.22 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -0.66 ± eV
Point Group Symmetry C1
Synonyms
  • 2-hydroxy-4-methyl-6-oxo-1-(2-phenylethyl)-3-pyridinecarbonitrile
  • 2-hydroxy-6-keto-4-methyl-1-(2-phenylethyl)nicotinonitrile
  • 3-pyridinecarbonitrile, 1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1-(2-phenylethyl)-
  • 6-hydroxy-4-methyl-2-oxo-1-phenethyl-1,2-dihydro-pyridine-3-carbonitrile
  • bas 03294131
  • chemdiv3_014790
  • oprea1_839313
  • sdccgmls-0064441.p001
CAS Number(s)
  • 68612-93-1
InChIKey JKVMGMSFODGPLF-UHFFFAOYSA-N
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