2-Fluoro-4-(trifluoromethyl)benzonitrile

The CAS register number of 2-Fluoro-4-(trifluoromethyl)benzonitrile is 146070-34-0. It also can be called as 3-Fluoro-4-cyanobenzotrifluoride and the IUPAC name about this chemical is 2-fluoro-4-(trifluoromethyl)benzonitrile. The molecular formula about this chemical is C₈H₃F₄N and the molecular weight is 189.11. It belongs to the following product categories, such as Fluorobenzene; Aromatic Nitriles; Miscellaneous and so on.

Physical properties about 2-Fluoro-4-(trifluoromethyl)benzonitrile are: (1)ACD/LogP: 2.32; (2)ACD/LogD (pH 5.5): 2.32; (3)ACD/LogD (pH 7.4): 2.32; (4)ACD/BCF (pH 5.5): 34.09; (5)ACD/BCF (pH 7.4): 34.09; (6)ACD/KOC (pH 5.5): 435.14; (7)ACD/KOC (pH 7.4): 435.14; (8)#H bond acceptors: 1; (9)Polar Surface Area: 23.79Ų; (10)Index of Refraction: 1.443; (11)Molar Refractivity: 36.42 cm³; (12)Molar Volume: 137.1 cm³; (13)Polarizability: 14.43x10^-24cm³; (14)Surface Tension: 30.4 dyne/cm; (15)Enthalpy of Vaporization: 42.67 kJ/mol; (16)Boiling Point: 190.5 °C at 760 mmHg; (17)Vapour Pressure: 0.539 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed and it is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice and in case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1ccc(cc1F)C(F)(F)F
(2)InChI: InChI=1/C8H3F4N/c9-7-3-6(8(10,11)12)2-1-5(7)4-13/h1-3H
(3)InChIKey: JLTYVTXTSOYXMX-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C8H3F4N/c9-7-3-6(8(10,11)12)2-1-5(7)4-13/h1-3H
(5)Std. InChIKey: JLTYVTXTSOYXMX-UHFFFAOYSA-N