Molecular Structure of 2-Bromo-4-methylpyridine-3-carbonitrile (CAS No.65996-02-3):
Molecular Formula: C7H5BrN2
Molecular Weight: 197.032
CAS No: 65996-02-3
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 0
Polar Surface Area: 36.68 Å2
Index of Refraction: 1.594
Molar Refractivity: 41.463 cm3
Molar Volume: 122.129 cm3
Surface Tension: 58.601 dyne/cm
Density: 1.613 g/cm3
Flash Point: 142.34 °C
Enthalpy of Vaporization: 55.269 kJ/mol
Boiling Point: 311.748 °C at 760 mmHg
Vapour Pressure: 0.001 mmHg at 25°C
InChI: InChI=1/C7H5BrN2/c1-5-2-3-10-7(8)6(5)4-9/h2-3H,1H3
InChIKey: IUOLDVXLQXLZMZ-UHFFFAOYAQ
Std. InChI: InChI=1S/C7H5BrN2/c1-5-2-3-10-7(8)6(5)4-9/h2-3H,1H3
Std. InChIKey: IUOLDVXLQXLZMZ-UHFFFAOYSA-N
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