2-Chloro-6-fluorobenzyl Bromide

The Benzene,2-(bromomethyl)-1-chloro-3-fluoro-, with the CAS registry number 68220-26-8, is also known as 2-Chloro-6-fluorobenzyl bromide. It belongs to the product categories of Aromatic Halides (substituted); Aryl; C₇; Halogenated Hydrocarbons. This chemical's molecular formula is C₇H₅BrClF and formula weight is 223.47. What's more, its IUPAC name is 2-(bromomethyl)-1-chloro-3-fluorobenzene.

Physical properties of Benzene,2-(bromomethyl)-1-chloro-3-fluoro- are: (1)ACD/LogP: 3.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.12; (4)ACD/BCF (pH 5.5): 139.54; (5)ACD/KOC (pH 5.5): 1193.38; (6)#Freely Rotating Bonds: 1; (7)Index of Refraction: 1.561; (8)Molar Refractivity: 43.78 cm³; (9)Molar Volume: 135 cm³; (10)Surface Tension: 39.7 dyne/cm; (11)Density: 1.654 g/cm³; (12)Flash Point: 88.1 °C; (13)Enthalpy of Vaporization: 43.98 kJ/mol; (14)Boiling Point: 222 °C at 760 mmHg; (15)Vapour Pressure: 0.155 mmHg at 25°C.

Uses of Benzene,2-(bromomethyl)-1-chloro-3-fluoro-: it can be used to produce 2-(2-chloro-6-fluoro-benzylsulfanyl)-6-methyl-1H-benzoimidazole at the temperature of 20°C. It will need reagent CH₃ONa and solvent methanol, dimethylformamide, methanol, dimethylformamide with the reaction time of 10 min. The yield is about 73%.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing and gloves.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C(=C1)Cl)CBr)F
(2)InChI: InChI=1S/C7H5BrClF/c8-4-5-6(9)2-1-3-7(5)10/h1-3H,4H2
(3)InChIKey: IGUVNNXFTDCASP-UHFFFAOYSA-N