3-FLUORO-5-(TRIFLUOROMETHYL)BENZOYL CHLORIDE

The Benzoyl chloride,3-fluoro-5-(trifluoromethyl)-, with CAS registry number 171243-30-4, belongs to the following product categories: (1)Aromatic Halides (substituted); (2)Acid Halides; (3)Carbonyl Compounds; (4)Organic Building Blocks. It has the systematic name of 3-fluoro-5-(trifluoromethyl)benzoyl chloride. And the chemical formula of this chemical is C₈H₃ClF₄O.

Physical properties of Benzoyl chloride,3-fluoro-5-(trifluoromethyl)-: (1)ACD/LogP: 3.36; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.36; (4)ACD/LogD (pH 7.4): 3.36; (5)ACD/BCF (pH 5.5): 210.18; (6)ACD/BCF (pH 7.4): 210.18; (7)ACD/KOC (pH 5.5): 1600.01; (8)ACD/KOC (pH 7.4): 1600.01; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.452; (14)Molar Refractivity: 41.47 cm³; (15)Molar Volume: 153.5 cm³; (16)Polarizability: 16.44×10^-24cm³; (17)Surface Tension: 28.7 dyne/cm; (18)Density: 1.475 g/cm³; (19)Flash Point: 73.3 °C; (20)Enthalpy of Vaporization: 43.38 kJ/mol; (21)Boiling Point: 197.6 °C at 760 mmHg; (22)Vapour Pressure: 0.375 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Benzoyl chloride,3-fluoro-5-(trifluoromethyl)- may cause burns. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice. After using it, take off immediately all contaminated clothing. 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: FC(F)(F)c1cc(cc(F)c1)C(Cl)=O
(2)InChI: InChI=1/C8H3ClF4O/c9-7(14)4-1-5(8(11,12)13)3-6(10)2-4/h1-3H
(3)InChIKey: BGAKSLBTFLVNAH-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C8H3ClF4O/c9-7(14)4-1-5(8(11,12)13)3-6(10)2-4/h1-3H
(5)Std. InChIKey: BGAKSLBTFLVNAH-UHFFFAOYSA-N