3-Pyridinecarbonitrile,6-(dimethylamino)- (154924-17-1)

The IUPAC name of 6-(Dimethylamino)nicotinonitrile is 6-(Dimethylamino)pyridine-3-carbonitrile. With the CAS registry number 154924-17-1, it is also named as 3-Pyridinecarbonitrile,6-(dimethylamino)-. The product's category is pyridine. In addition, its molecular formula is C₈H₉N₃ and its molecular weight is 147.18. 

The other characteristics of 6-(Dimethylamino)nicotinonitrile can be summarized as: (1)ACD/LogP: 1.75; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.734; (4)ACD/LogD (pH 7.4): 1.753; (5)ACD/BCF (pH 5.5): 12.111; (6)ACD/BCF (pH 7.4): 12.65; (7)ACD/KOC (pH 5.5): 204.895; (8)ACD/KOC (pH 7.4): 214.008; (9)H bond acceptors: 3; (10)H bond donors: 0; (11)Freely Rotating Bonds: 1; (12)Polar Surface Area: 39.92 Å²; (13)Index of Refraction: 1.552; (14)Molar Refractivity: 42.254 cm³; (15)Molar Volume: 132.24 cm³; (16)Polarizability: 16.751×10^-24cm³; (17)Surface Tension: 50.914 dyne/cm; (18)Density: 1.113 g/cm³; (19)Flash Point: 153.938 °C; (20)Melting Point: 66-68 °C; (21)Enthalpy of Vaporization: 57.355 kJ/mol; (22)Boiling Point: 330.925 °C at 760 mmHg; (23)Vapour Pressure: 0 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:CN(C)c1ccc(cn1)C#N
(2)InChI:InChI=1/C8H9N3/c1-11(2)8-4-3-7(5-9)6-10-8/h3-4,6H,1-2H3
(3)InChIKey:YIZXYFJKSCABES-UHFFFAOYAO
(4)Std. InChI:InChI=1S/C8H9N3/c1-11(2)8-4-3-7(5-9)6-10-8/h3-4,6H,1-2H3
(5)Std. InChIKey:YIZXYFJKSCABES-UHFFFAOYSA-N