Molecular Structure of 2-Hydroxy-4-methylpyridine-3-carbonitrile (CAS NO.93271-59-1):
Systematic Name: 4-Methyl-2-oxo-1H-pyridine-3-carbonitrile
Molecular Formula: C7H6N2O
Molecular Weight: 134.13
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 0
Nominal Mass: 134
Average Mass: 134.135
Monoisotopic Mass: 134.048
Index of Refraction: 1.553
Molar Refractivity: 35.483 cm3
Molar Volume: 110.91 cm3
Surface Tension: 47.587 dyne/cm
Density: 1.209 g/cm3
Flash Point: 158.005 °C
Enthalpy of Vaporization: 58.092 kJ/mol
Boiling Point: 337.65 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25 °C
Product Categories: Pyridine
SMILES: Cc1cc[nH]c(=O)c1C#N
InChI: InChI=1/C7H6N2O/c1-5-2-3-9-7(10)6(5)4-8/h2-3H,1H3,(H,9,10)
InChIKey: XSJRLWNOZDULKJ-UHFFFAOYAA
2-Hydroxy-4-methylpyridine-3-carbonitrile (CAS NO.93271-59-1), its Synonyms are 3-Pyridinecarbonitrile,1,2-dihydro-4-methyl-2-oxo- ; 4-Methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile .
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