3-Chloro-2-fluorobenzyl bromide

The Benzene,1-(bromomethyl)-3-chloro-2-fluoro-, with CAS registry number 85070-47-9, has the systematic name of 1-(bromomethyl)-3-chloro-2-fluorobenzene. Besides this, it is also called 3-chloro-2-fluorobenzyl bromide. And the chemical formula of this chemical is C₇H₅BrClF.

Physical properties of Benzene,1-(bromomethyl)-3-chloro-2-fluoro-: (1)ACD/LogP: 3.68; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.68; (4)ACD/LogD (pH 7.4): 3.68; (5)ACD/BCF (pH 5.5): 365.68; (6)ACD/BCF (pH 7.4): 365.68; (7)ACD/KOC (pH 5.5): 2378.35; (8)ACD/KOC (pH 7.4): 2378.35; (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: 1.561; (14)Molar Refractivity: 43.78 cm³; (15)Molar Volume: 135 cm³; (16)Polarizability: 17.35×10^-24cm³; (17)Surface Tension: 39.7 dyne/cm; (18)Density: 1.654 g/cm³; (19)Flash Point: 92.9 °C; (20)Enthalpy of Vaporization: 44.77 kJ/mol; (21)Boiling Point: 230 °C at 760 mmHg; (22)Vapour Pressure: 0.102 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Benzene,1-(bromomethyl)-3-chloro-2-fluoro- irritates to eyes, respiratory system and skin. And this chemical 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.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1c(cccc1Cl)CBr
(2)InChI: InChI=1/C7H5BrClF/c8-4-5-2-1-3-6(9)7(5)10/h1-3H,4H2
(3)InChIKey: HYILLTADABKYHO-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C7H5BrClF/c8-4-5-2-1-3-6(9)7(5)10/h1-3H,4H2
(5)Std. InChIKey: HYILLTADABKYHO-UHFFFAOYSA-N