2-Fluoro-4-iodo-6-(trifluoromethyl)pyridine CAS NO.957345-37-8

2-Fluoro-4-iodo-6-(trifluoromethyl)pyridine is an organic compound with the formula C₆H₂F₄IN, and its systematic name is the same with the product name. With the CAS registry number 957345-37-8, it is also named as Pyridine, 2-fluoro-4-iodo-6-(trifluoromethyl)-. In addition, the molecular weight is 290.98.

Physical properties of 2-Fluoro-4-iodo-6-(trifluoromethyl)pyridine are: (1)ACD/LogP: 3.214; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.21; (4)ACD/LogD (pH 7.4): 3.21; (5)ACD/BCF (pH 5.5): 163.09; (6)ACD/BCF (pH 7.4): 163.09; (7)ACD/KOC (pH 5.5): 1334.30; (8)ACD/KOC (pH 7.4): 1334.30; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å²; (13)Index of Refraction: 1.505; (14)Molar Refractivity: 42.225 cm³; (15)Molar Volume: 142.45 cm³; (16)Polarizability: 16.739×10^-24cm³; (17)Surface Tension: 32.98 dyne/cm; (18)Density: 2.043 g/cm³; (19)Flash Point: 77.965 °C; (20)Enthalpy of Vaporization: 42.351 kJ/mol; (21)Boiling Point: 205.304 °C at 760 mmHg; (22)Vapour Pressure: 0.4 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c(cc(nc1C(F)(F)F)F)I
(2)Std. InChI: InChI=1S/C6H2F4IN/c7-5-2-3(11)1-4(12-5)6(8,9)10/h1-2H
(3)Std. InChIKey: CCDJZXRRHMOHBL-UHFFFAOYSA-N