4-BROMO-3-(TRIFLUOROMETHYL)BENZENESULFONAMIDE

The Benzenesulfonamide, 4-bromo-3-(trifluoromethyl)-, with the CAS registry number of 351003-64-0, is also known as 4-Bromo-3-(trifluoromethyl)benzene sulphonamide and 4-Bromo-3-(trifluoromethyl). It belongs to the product categories of Organic Building Blocks; Sulfonamides/Sulfinamides; Sulfur Compounds. This chemical's molecular formula is C₇H₅BrF₃NO₂S and molecular weight is 304.08. What's more, its systematic name is called 4-Bromo-3-(trifluoromethyl)benzenesulfonamide. In addition, it must be stored in airtight containers and placed in a dry, cool, ventilated place. Meanwhile, it should avoid contact with reductant, high temperature, flame.

Physical properties about Benzenesulfonamide, 4-bromo-3-(trifluoromethyl)- are: (1)ACD/LogP: 2.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.17; (4)ACD/LogD (pH 7.4): 2.16; (5)ACD/BCF (pH 5.5): 26.13; (6)ACD/BCF (pH 7.4): 25.93; (7)ACD/KOC (pH 5.5): 359.74; (8)ACD/KOC (pH 7.4): 356.95; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 45.76 Å²; (13)Index of Refraction: 1.529; (14)Molar Refractivity: 51.9 cm³; (15)Molar Volume: 168 cm³; (16)Polarizability: 20.57×10^-24 cm³; (17)Surface Tension: 41.2 dyne/cm; (18)Density: 1.809 g/cm³; (19)Flash Point: 166.9 °C; (20)Enthalpy of Vaporization: 59.71 kJ/mol; (21)Boiling Point: 352.3 °C at 760 mmHg; (22)Vapour Pressure: 3.87E-05 mmHg at 25 °C; (23)Melting Point: 185-189 °C(lit. ).

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is harmful if swallowed. In addition, the dust of this chemical can not be breathed. During using it, wear suitable protective clothing and gloves.

You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)(F)c1cc(ccc1Br)S(=O)(=O)N
(2) InChI: InChI=1/C7H5BrF3NO2S/c8-6-2-1-4(15(12,13)14)3-5(6)7(9,10)11/h1-3H,(H2,12,13,14)
(3) InChIKey: GQUUOLHRLZCAIO-UHFFFAOYAM