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The 2-Amino-4-methyl-quinoline-3-carbonitrile, with the CAS registry number 28448-11-5, is also known as 2-Amino-4-methyl-3-quinolinecarbonitrile. This chemical's molecular formula is C11H9N3 and molecular weight is 183.21. What's more, its systematic name is called 2-Amino-4-methylquinoline-3-carbonitrile.
Physical properties about 2-Amino-4-methyl-quinoline-3-carbonitrile are: (1)ACD/LogP: 2.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.7; (4)ACD/LogD (pH 7.4): 2.71; (5)ACD/BCF (pH 5.5): 65.5; (6)ACD/BCF (pH 7.4): 67.41; (7)ACD/KOC (pH 5.5): 688.73; (8)ACD/KOC (pH 7.4): 708.88; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 39.92 Å2; (13)Index of Refraction: 1.672; (14)Molar Refractivity: 54.91 cm3; (15)Molar Volume: 146.5 cm3; (16)Surface Tension: 67.2 dyne/cm; (17)Density: 1.24 g/cm3; (18)Flash Point: 195.2 °C; (19)Enthalpy of Vaporization: 64.97 kJ/mol; (20)Boiling Point: 399.1 °C at 760 mmHg; (21)Vapour Pressure: 1.41E-06 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: N#Cc1c(c2ccccc2nc1N)C
(2) InChI: InChI=1/C11H9N3/c1-7-8-4-2-3-5-10(8)14-11(13)9(7)6-12/h2-5H,1H3,(H2,13,14)
(3) InChIKey: DXXUIIMDJKUSES-UHFFFAOYAC