1,1'-Biphenyl,2,2',4,5-tetrachloro- supplier

Name
2,2',4,5-TETRACHLOROBIPHENYL
EINECS
CAS No. 70362-47-9
Article Data1
CAS DataBase
Density 1.441g/cm³
Solubility 16.44ug/L(25 oC)
Melting Point 65.9°C
Formula C₁₂H₆Cl₄
Boiling Point 344.8 °C at 760 mmHg
Molecular Weight 291.992
Flash Point 161.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,2',4,5-Tetrachlorobiphenyl;2,4,5,2'-Tetrachlorobiphenyl;PCB 48;
PSA 0.00000
LogP 5.96720

1,1'-Biphenyl,2,2',4,5-tetrachloro- Specification

The 1,1'-Biphenyl,2,2',4,5-tetrachloro-, with CAS registry number 70362-47-9, has the systematic name of 2,2',4,5-tetrachlorobiphenyl. And its IUPAC name is 1,2,4-trichloro-5-(2-chlorophenyl)benzene. What's more, the chemical formula of this chemical is C₁₂H₆Cl₄.

Physical properties of 1,1'-Biphenyl,2,2',4,5-tetrachloro-: (1)ACD/LogP: 5.88; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.88; (4)ACD/LogD (pH 7.4): 5.88; (5)ACD/BCF (pH 5.5): 17418.29; (6)ACD/BCF (pH 7.4): 17418.29; (7)ACD/KOC (pH 5.5): 37783.19; (8)ACD/KOC (pH 7.4): 37783.19; (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: 1.612; (14)Molar Refractivity: 70.42 cm³; (15)Molar Volume: 202.5 cm³; (16)Polarizability: 27.91×10^-24cm³; (17)Surface Tension: 44.8 dyne/cm; (18)Density: 1.441 g/cm³; (19)Flash Point: 161.9 °C; (20)Enthalpy of Vaporization: 56.56 kJ/mol; (21)Boiling Point: 344.8 °C at 760 mmHg; (22)Vapour Pressure: 0.000128 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2cc(c1ccccc1Cl)c(Cl)cc2Cl
(2)InChI: InChI=1/C12H6Cl4/c13-9-4-2-1-3-7(9)8-5-11(15)12(16)6-10(8)14/h1-6H
(3)InChIKey: XBTHILIDLBPRPM-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C12H6Cl4/c13-9-4-2-1-3-7(9)8-5-11(15)12(16)6-10(8)14/h1-6H
(5)Std. InChIKey: XBTHILIDLBPRPM-UHFFFAOYSA-N

Product Name

2,2',4,5-TETRACHLOROBIPHENYL

1,1'-Biphenyl,2,2',4,5-tetrachloro- Specification

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