2,4,6-TRICHLOROBIPHENYL

The CAS registry number of 1,1'-Biphenyl,2,4,6-trichloro- is 35693-92-6. Its systematic name is 2,4,6-trichlorobiphenyl. In addition, the molecular formula is C₁₂H₇Cl₃ and the molecular weight is 257.54. What's more, it should be stored in sealed container, and put in a cool and dry place.

Physical properties about 1,1'-Biphenyl,2,4,6-trichloro- are: (1)ACD/LogP: 5.54; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.54; (4)ACD/LogD (pH 7.4): 5.54; (5)ACD/BCF (pH 5.5): 9550.13; (6)ACD/BCF (pH 7.4): 9550.13; (7)ACD/KOC (pH 5.5): 24574.26; (8)ACD/KOC (pH 7.4): 24574.26; (9)#Freely Rotating Bonds: 1; (10)Index of Refraction: 1.603; (11)Molar Refractivity: 65.52 cm³; (12)Molar Volume: 190.5 cm³; (13)Polarizability: 25.97 ×10^-24cm³; (14)Surface Tension: 43 dyne/cm; (15)Density: 1.351 g/cm³; (16)Flash Point: 213.7 °C; (17)Enthalpy of Vaporization: 53.36 kJ/mol; (18)Boiling Point: 314.6 °C at 760 mmHg; (19)Vapour Pressure: 0.000852 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is highly flammable and irritating to the skin. It may cause lung damage if swallowed and may cause drowsiness and dizziness. In addition, it is very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. So this material and/or its container must be disposed of as hazardous waste. If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label. Moreover, you should avoid release to the environment and you can refer to special instructions safety data sheet.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2cc(Cl)cc(Cl)c2c1ccccc1
(2)Std. InChI: InChI=1S/C12H7Cl3/c13-9-6-10(14)12(11(15)7-9)8-4-2-1-3-5-8/h1-7H
(3)Std. InChIKey: MTLMVEWEYZFYTH-UHFFFAOYSA-N