2,2-Bis(3-aminophenyl)hexafluoropropane

The 2,2-Bis(3-aminophenyl)hexafluoropropane, with the CAS registry number 47250-53-3, is also known as 3,3'-(1,1,1,3,3,3-Hexafluoropropane-2,2-diyl)dianiline. It belongs to the product categories of Bisphenol AF type Compounds (for High-Performance Polymer Research); Functional Materials; Reagent for High-Performance Polymer Research. This chemical's molecular formula is C₁₅H₁₂F₆N₂ and molecular weight is 334.2596. What's more, its IUPAC name is 3-[2-(3-Aminophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]aniline. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes. In addition, it should be sealed up and stored in condition of cold and dry.

Physical properties about 2,2-Bis(3-aminophenyl)hexafluoropropane are: (1)ACD/LogP: 1.73; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.72; (4)ACD/LogD (pH 7.4): 1.73; (5)ACD/BCF (pH 5.5): 11.91; (6)ACD/BCF (pH 7.4): 12.09; (7)ACD/KOC (pH 5.5): 204.15; (8)ACD/KOC (pH 7.4): 207.17; (9)#H bond acceptors: 2; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 6.48 Å²; (13)Index of Refraction: 1.526; (14)Molar Refractivity: 73.79 cm³; (15)Molar Volume: 240 cm³; (16)Polarizability: 29.25×10^-24 cm³; (17)Surface Tension: 36.1 dyne/cm; (18)Density: 1.392 g/cm³; (19)Flash Point: 158.2 °C; (20)Enthalpy of Vaporization: 59.29 kJ/mol; (21)Boiling Point: 348.5 °C at 760 mmHg; (22)Vapour Pressure: 5E-05 mmHg at 25 °C; (23) Melting Point: 86 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)(F)C(c1cc(N)ccc1)(c2cccc(N)c2)C(F)(F)F
(2) InChI: InChI=1/C15H12F6N2/c16-14(17,18)13(15(19,20)21,9-3-1-5-11(22)7-9)10-4-2-6-12(23)8-10/h1-8H,22-23H2
(3) InChIKey: UVUCUHVQYAPMEU-UHFFFAOYAL