2-CHLORO-6-FLUORO-4-(TRIFLUOROMETHYL)PHENOL 98

The 2-Chloro-6-fluoro-4-(trifluoromethyl)phenol is an organic compound with the formula C₇H₃ClF₄O. The systematic name of this chemical is 2-chloro-6-fluoro-4-(trifluoromethyl)phenol. With the CAS registry number 116640-09-6, the product's category is Phenol & Thiophenol & Mercaptan.

Physical properties about 2-Chloro-6-fluoro-4-(trifluoromethyl)phenol are: (1)ACD/LogP: 3.20; (2)ACD/LogD (pH 5.5): 3.04; (3)ACD/LogD (pH 7.4): 1.65; (4)ACD/BCF (pH 5.5): 110.39; (5)ACD/BCF (pH 7.4): 4.48; (6)ACD/KOC (pH 5.5): 908.43; (7)ACD/KOC (pH 7.4): 36.85; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 20.23 Å²; (12)Index of Refraction: 1.464; (13)Molar Refractivity: 38 cm³; (14)Molar Volume: 137.5 cm³; (15)Polarizability: 15.06×10^-24cm³; (16)Surface Tension: 30.2 dyne/cm; (17)Density: 1.559 g/cm³; (18)Flash Point: 53.9 °C; (19)Enthalpy of Vaporization: 41.85 kJ/mol; (20)Boiling Point: 165.4 °C at 760 mmHg; (21)Vapour Pressure: 1.43 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection and do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer).

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(cc(Cl)c1O)C(F)(F)F
(2)InChI: InChI=1/C7H3ClF4O/c8-4-1-3(7(10,11)12)2-5(9)6(4)13/h1-2,13H
(3)InChIKey: GMDXDJVADBEUBV-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C7H3ClF4O/c8-4-1-3(7(10,11)12)2-5(9)6(4)13/h1-2,13H
(5)Std. InChIKey: GMDXDJVADBEUBV-UHFFFAOYSA-N