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Basic Information
CAS No.: 74472-35-8
Name: 2,3,3',4,6-PENTACHLOROBIPHENYL
Molecular Structure:
Molecular Structure of 74472-35-8 (2,3,3',4,6-PENTACHLOROBIPHENYL)
Formula: C12H5Cl5
Molecular Weight: 326.437
Synonyms: 2,3,3',4,6-Pentachlorobiphenyl;2,3,4,6,3'-Pentachlorobiphenyl;PCB 109;2,3,3',4,6-Pentachloro-1,1'-biphenyl;
Density: 1.522 g/cm3
Melting Point: 95.86°C (estimate)
Boiling Point: 373 °C at 760 mmHg
Flash Point: 179.3 °C
PSA: 0.00000
LogP: 6.62060
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Specification

The 1,1'-Biphenyl,2,3,3',4,6-pentachloro-, with the CAS registry number 74472-35-8, is also known as 2,3,3',4,6-Pentachloro-1,1'-biphenyl. This chemical's molecular formula is C12H5Cl5 and molecular weight is 326.43. What's more, its systematic name is 2,3,3',4,6-pentachlorobiphenyl. 

Physical properties of 1,1'-Biphenyl,2,3,3',4,6-pentachloro- are: (1)ACD/LogP: 6.35; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.35; (4)ACD/LogD (pH 7.4): 6.35; (5)ACD/BCF (pH 5.5): 39336.76; (6)ACD/BCF (pH 7.4): 39336.76; (7)ACD/KOC (pH 5.5): 67692.45; (8)ACD/KOC (pH 7.4): 67692.45; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 0 Å2; (11)Index of Refraction: 1.619; (12)Molar Refractivity: 75.31 cm3; (13)Molar Volume: 214.4 cm3; (14)Polarizability: 29.85×10-24 cm3; (15)Surface Tension: 46.4 dyne/cm; (16)Density: 1.522 g/cm3; (17)Flash Point: 179.3 °C; (18)Enthalpy of Vaporization: 59.59 kJ/mol; (19)Boiling Point: 373 °C at 760 mmHg; (20)Vapour Pressure: 1.98E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: Clc1c(c(Cl)c(Cl)c(Cl)c1)c2cccc(Cl)c2
(2)InChI: InChI=1/C12H5Cl5/c13-7-3-1-2-6(4-7)10-8(14)5-9(15)11(16)12(10)17/h1-5H
(3)InChIKey: XGQBSVVYMVILEL-UHFFFAOYAG