4'-Bromo-2'-fluoroacetanilide

The IUPAC name of this chemical is N-(4-Bromo-2-fluorophenyl)acetamide. With the CAS registry number 326-66-9 and EINECS registry number 206-314-6, it is also named as acetamide,N-(4-bromo-2-fluorophenyl)-. In addition, the molecular formula is C₈H₇BrFNO and the molecular weight is 232.05. It is a kind of light beige amorphous powder and belongs to the classes of Fluorobenzene; Benzenes; Anilines, Amides & Amines; Bromine Compounds; Fluorine Compounds; Nitrogen Compounds; Organic Building Blocks; Protected Amines. And it should be stored in a cool and dry place.

Physical properties about this chemical are: (1)ACD/LogP: 2.10; (2)ACD/LogD (pH 5.5): 2.1; (3)ACD/LogD (pH 7.4): 2.1; (4)ACD/BCF (pH 5.5): 23.19; (5)ACD/BCF (pH 7.4): 23.19; (6)ACD/KOC (pH 5.5): 330.29; (7)ACD/KOC (pH 7.4): 330.29; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 20.31 Å²; (12)Index of Refraction: 1.589; (13)Molar Refractivity: 48.2 cm³; (14)Molar Volume: 142.9 cm³; (15)Polarizability: 19.11 ×10^-24cm³; (16)Surface Tension: 44.2 dyne/cm; (17)Density: 1.623 g/cm³; (18)Flash Point: 155.1 °C; (19)Enthalpy of Vaporization: 57.57 kJ/mol; (20)Boiling Point: 332.9 °C at 760 mmHg; (21)Vapour Pressure: 0.000141 mmHg at 25°C.

Preparation of N-(4-Bromo-2-fluorophenyl)acetamide: it can be prepared by N-(4-bromo-phenyl)-acetamide. This reaction will need reagent CH₃COOF and solvents CH₂Cl₂ and CCl₃F. The yield is about 65% at reaction temperature of-75 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful if swallowed and irritating to eyes, respiratory system and skin. If contact it with skin, you should wash it immediately with plenty of ... (to be specified by the manufacturer). In addition, in case of accident or if you feel unwell, seek medical advice immediately (show label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc(F)c(NC(=O)C)cc1
(2)InChI: InChI=1/C8H7BrFNO/c1-5(12)11-8-3-2-6(9)4-7(8)10/h2-4H,1H3,(H,11,12)
(3)InChIKey: BCYGKMDWQBWUSC-UHFFFAOYAW