3-CHLORO-2,6-DIFLUOROBENZYL BROMIDE

The Benzene, 2-(bromomethyl)-4-chloro-1, 3-difluoro-, with the CAS registry number 261762-47-4, is also known as 3-Chloro-2, 6-difluorobenzyl bromide. This chemical's molecular formula is C₇H₄BrClF₂ and molecular weight is 241.46. What's more, its IUPAC name is 3-(Bromomethyl)-1-chloro-2, 4-difluorobenzene. In addition, it must be stored in airtight containers and placed in a dry, cool, ventilated place. Meanwhile, it should be kept away from oxidant, moisture, alkali.

Physical properties about Benzene, 2-(bromomethyl)-4-chloro-1, 3-difluoro- are: (1)ACD/LogP: 3.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.71; (4)ACD/LogD (pH 7.4): 3.71; (5)ACD/BCF (pH 5.5): 391.7; (6)ACD/BCF (pH 7.4): 391.7; (7)ACD/KOC (pH 5.5): 2498.28; (8)ACD/KOC (pH 7.4): 2498.28; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.541; (14)Molar Refractivity: 43.78 cm³; (15)Molar Volume: 139.2 cm³; (16)Polarizability: 17.35×10^-24 cm³; (17)Surface Tension: 38.2 dyne/cm; (18)Density: 1.733 g/cm³; (19)Flash Point: 88.6 °C; (20)Enthalpy of Vaporization: 44.07 kJ/mol; (21)Boiling Point: 222.9 °C at 760 mmHg; (22)Vapour Pressure: 0.147 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical may cause burns. During using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1c(c(F)ccc1Cl)CBr
(2) InChI: InChI=1/C7H4BrClF2/c8-3-4-6(10)2-1-5(9)7(4)11/h1-2H,3H2
(3) InChIKey: SNOJSRMVFAKBEG-UHFFFAOYAH