2-Fluoro-5-(trifluoromethyl)phenol

The 2-Fluoro-5-(trifluoromethyl)phenol, with the CAS registry number 141483-15-0, is also known as Phenol, 2-fluoro-5-(trifluoromethyl)-. It belongs to the product categories of Aromatic Phenols; Phenol & Thiophenol & Mercaptan; Organic Building Blocks; Oxygen Compounds; Phenols. This chemical's molecular formula is C₇H₄F₄O and molecular weight is 180.10. What's more, its IUPAC name is the same with its product name. It is should be kept in a cold, dry and ventilated place.

Physical properties about 2-Fluoro-5-(trifluoromethyl)phenol are: (1)ACD/LogP: 3.291; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.29; (4)ACD/LogD (pH 7.4): 3.12; (5)ACD/BCF (pH 5.5): 185.68; (6)ACD/BCF (pH 7.4): 124.86; (7)ACD/KOC (pH 5.5): 1461.55; (8)ACD/KOC (pH 7.4): 982.83; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 20.23 Å²; (13)Index of Refraction: 1.44; (14)Molar Refractivity: 33.108 cm³; (15)Molar Volume: 125.584 cm³; (16)Polarizability: 13.125×10^-24cm³; (17)Surface Tension: 27.132 dyne/cm; (18)Density: 1.434 g/cm³; (19)Flash Point: 52.559 °C; (20)Enthalpy of Vaporization: 41.628 kJ/mol; (21)Boiling Point: 163.294 °C at 760 mmHg; (22)Vapour Pressure: 1.588 mmHg at 25 °C.

Uses of 2-Fluoro-5-(trifluoromethyl)phenol: it is used to produce other chemicals. For example, it can react with 3-bromo-propene to get 2-allyloxy-1-fluoro-4-trifluoromethyl-benzene. The reaction type is Alkylation. This reaction needs reagent K₂CO₃ and solvent dimethylformamide at temperature of 80 °C. The reaction time is 2 hours. The yield is 92 %.

When you are dealing with this chemical, you should be very careful. This chemical may cause damage to health and may cause damage to healthat low levels. It is harmful by inhalation, in contact with skin and if swallowed. And it is irritating to eyes, respiratory system and skin. Therefore, you should wear suitable protective clothing. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1ccc(cc1O)C(F)(F)F
(2) InChI: InChI=1S/C7H4F4O/c8-5-2-1-4(3-6(5)12)7(9,10)11/h1-3,12H
(3) InChIKey: MCOSBFKOUQAIJS-UHFFFAOYSA-N