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74472-34-7

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Basic Information
CAS No.: 74472-34-7
Name: 2,3,4',5-TETRACHLOROBIPHENYL
Article Data: 2
Molecular Structure:
Molecular Structure of 74472-34-7 (2,3,4',5-TETRACHLOROBIPHENYL)
Formula: C12H6Cl4
Molecular Weight: 291.988
Synonyms: 2,3,4,5-Tetrachlorobiphenyl;
Density: 1.441 g/cm3
Melting Point: 106.53°C (estimate)
Boiling Point: 361.5 °C at 760mmHg
Flash Point: 174.2 °C
Solubility: 26.27ug/L(20 oC)
Hazard Symbols: DangerousN
Risk Codes: 33-50/53
Safety: 35-60-61
PSA: 0.00000
LogP: 5.96720
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Specification

This chemical is called 1,2,5-Trichloro-3-(4-chlorophenyl)benzene, and it's also named as 1,1'-Biphenyl, 2,3,4',5-tetrachloro-. With the molecular formula of C12H6Cl4, its molecular weight is 291.988. The CAS registry number of this chemical is 74472-34-7.

Other characteristics of the 1,2,5-Trichloro-3-(4-chlorophenyl)benzene can be summarised as followings: (1)ACD/LogP: 5.97; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.97; (4)ACD/LogD (pH 7.4): 5.97; (5)ACD/BCF (pH 5.5): 20306.2; (6)ACD/BCF (pH 7.4): 20306.2; (7)ACD/KOC (pH 5.5): 42168.36; (8)ACD/KOC (pH 7.4): 42168.36; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1 ; (12)Index of Refraction: 1.612; (13)Molar Refractivity: 70.42 cm3; (14)Molar Volume: 202.5 cm3; (15)Polarizability: 27.91×10-24cm3; (16)Surface Tension: 44.8 dyne/cm; (17)Density: 1.441 g/cm3; (18)Flash Point: 174.2 °C; (19)Enthalpy of Vaporization: 58.34 kJ/mol; (20)Boiling Point: 361.5 °C at 760 mmHg; (21)Vapour Pressure: 4.29E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. Its container must be disposed of as hazardous waste. Avoid releasing it to the environment. In addition, it has danger of cumulative effects. Please refer to special instructions / safety data sheets if you use it.

You can still convert the following datas into molecular structure: 
1.SMILES: Clc2c(c1ccc(Cl)cc1)cc(Cl)cc2Cl
2.InChI: InChI=1/C12H6Cl4/c13-8-3-1-7(2-4-8)10-5-9(14)6-11(15)12(10)16/h1-6H
3.InChIKey: CITMYAMXIZQCJD-UHFFFAOYAO