2,6-BIS(TRIFLUOROMETHYL)PYRIDINE

The 2,6-Bis(trifluoromethyl)pyridine, with its CAS registry number 455-00-5, is also called as Pyridine, 2,6-bis(trifluoromethyl)-. And its product categories are including Pyridine; Heterocyclic Compounds.

The physical properties of this chemical are as below: (1)ACD/LogP: 2.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.15; (4)ACD/LogD (pH 7.4): 2.15; (5)ACD/BCF (pH 5.5): 25.33; (6)ACD/BCF (pH 7.4): 25.33; (7)ACD/KOC (pH 5.5): 351.84; (8)ACD/KOC (pH 7.4): 351.84; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89; (13)Index of Refraction: 1.375; (14)Molar Refractivity: 34.3 cm³; (15)Molar Volume: 149.6 cm³; (16)Polarizability: 13.59×10^-24 cm³; (17)Surface Tension: 19.8 dyne/cm; (18)Density: 1.437 g/cm³; (19)Flash Point: 16.4 °C; (20)Enthalpy of Vaporization: 32.84 kJ/mol; (21)Boiling Point: 103.5 °C at 760 mmHg; (22)Vapour Pressure: 37.3 mmHg at 25°C.

Production method of this chemical: pyridine-2,6-dicarboxylic acid could react to produce 2,6-Bis(trifluoromethyl)pyridine. This reaction could happen in the presence of the reagent of MoF6 and it needs the reaction time of 45 hours and the reaction temperature of 190 - 210 ℃ with its yield of 84%.

Use of this chemical: 2,6-Bis(trifluoromethyl)pyridine could react with tert-butyl-lithium to produce 2-tert-butyl-2,6-bis-trifluoromethyl-1,2-dihydro-pyridine. This reaction could happen in the presence of the solvent of pentane and diethyl ether, and it needs the reaction time of 10 mins and the reaction temperature of -78 - -70 ℃ with its yield of 36%.

 
When you are dealing with this chemical, you should be cautious. For one thing, it is irritating to eyes, respiratory system and skin and may cause inflammation to the skin or other mucous membranes. For another thing, it is toxic which may at low levels cause damage to health. In addition, it is highly flammable which may catch fire in contact with air, only needing brief contact with an ignition source, and it has a very low flash point or evolve highly flammable gases in contact with water. 

Therefore, you should take the following instructions to protect yourself. If in case of contact with eyes, rinse immediately with plenty of water and seek medical advice, and if in case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

Additionally, you could convert the following datas into the molecular structure:
(1)SMILES:FC(F)(F)c1nc(ccc1)C(F)(F)F
(2)InChI:InChI=1/C7H3F6N/c8-6(9,10)4-2-1-3-5(14-4)7(11,12)13/h1-3H
(3)InChIKey:YPDVFTXBESQIPJ-UHFFFAOYAC