1-BROMO-2,4-DICHLOROBENZENE

The Benzene,1-bromo-2,4-dichloro-, with CAS registry number 1193-72-2, belongs to the following product categories: (1)Benzene derivates; (2)Bromine Compounds; (3)Chlorine Compounds; (4)Aryl; (5)C6; (6)Halogenated Hydrocarbons. It has the systematic name of 1-bromo-2,4-dichloro-benzene. This chemical is a kind of colorless to light yellow crystalline mass.

Physical properties of Benzene,1-bromo-2,4-dichloro-: (1)ACD/LogP: 4.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.04; (4)ACD/LogD (pH 7.4): 4.04; (5)#H bond acceptors: 0; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: Å²; (9)Index of Refraction: 1.59; (10)Molar Refractivity: 43.73 cm³; (11)Molar Volume: 129.5 cm³; (12)Polarizability: 17.33×10^-24cm³; (13)Surface Tension: 41.8 dyne/cm; (14)Enthalpy of Vaporization: 45.44 kJ/mol; (15)Vapour Pressure: 0.0714 mmHg at 25°C.

Uses of Benzene,1-bromo-2,4-dichloro-: it can be used to produce 2,4,4'-trichloro-biphenyl. This reaction will need aq. Na₂CO₃ and solvents dioxane, ethanol. The yield is about 42%.

When you are using this chemical, please be cautious about it as the following:
The Benzene,1-bromo-2,4-dichloro- irritates to eyes, respiratory system and skin. 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: Clc1ccc(Br)c(Cl)c1
(2)InChI: InChI=1/C6H3BrCl2/c7-5-2-1-4(8)3-6(5)9/h1-3H
(3)InChIKey: ISHYFWKKWKXXPL-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C6H3BrCl2/c7-5-2-1-4(8)3-6(5)9/h1-3H
(5)Std. InChIKey: ISHYFWKKWKXXPL-UHFFFAOYSA-N