Chemical Properties of 1,1'-Biphenyl, 2,3,3',4,4',5-hexachloro- (CAS 38380-08-4)

1,1'-Biphenyl, 2,3,3',4,4',5-hexachloro-

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InChI
InChI=1S/C12H4Cl6/c13-7-2-1-5(3-8(7)14)6-4-9(15)11(17)12(18)10(6)16/h1-4H
InChI Key
LCXMEXLGMKFLQO-UHFFFAOYSA-N
Formula
C12H4Cl6
SMILES
Clc1ccc(-c2cc(Cl)c(Cl)c(Cl)c2Cl)cc1Cl
Molecular Weight1
360.88
CAS
38380-08-4
Other Names
  • 2,3,3',4,4',5-HEXACHLORO-1,1'-BIPHENYL
  • 2,3,3',4,4',5-Hexachlorobiphenyl
  • 2,3,4,5,3',4'-Hexachlorobiphenyl
  • 3,4,2',3',4',5'-Hexachlorobiphenyl
  • PCB 156
Sources

Physical Properties

Property Value Unit Source
Δf 145.62 kJ/mol Joback Calculated Property
Δfgas 18.79 kJ/mol Joback Calculated Property
Δfus 37.77 kJ/mol Joback Calculated Property
Δvap 112.60 ± 0.40 kJ/mol NIST
logPoct/wat 7.27 Crippen Calculated Property
Pc 2450.74 kPa Joback Calculated Property
Tboil 781.78 K Joback Calculated Property
Tc 1052.68 K Joback Calculated Property
Tfus 532.48 K Joback Calculated Property
Vc 0.79 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 401.07 J/mol×K 781.78 Joback Calculated Property
η 0.00 Pa×s 781.78 Joback Calculated Property
ΔvapH 94.80 kJ/mol 368.0 NIST

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 8
-Cl 6
=CH- (ring) 4

Similar Compounds

2,3,3',4,5,5'-Hexachloro-1,1'-biphenyl. 1,1'-Biphenyl, 2,3,3',4,4',5,5'-heptachloro-. 1,1'-Biphenyl, 2,3,4,4',5-pentachloro-. 1,1'-Biphenyl, 2,3,4,5-tetrachloro-. PCB 205. 1,1'-Biphenyl, 2,3,3',4,4',5,6-Heptachloro-. 1,1'-Biphenyl, 2,3,3',4,5,5',6-heptachloro-. 1,1'-Biphenyl, 2,3,3',4,5,6-hexachloro-. 1,1'-Biphenyl, 2,3,3',4,4',6-hexachloro. 1,1'-Biphenyl, 2,3,3',4,6-pentachloro-. PCB 161. 1,1'-Biphenyl, 2,3,3',4',5,5',6-heptachloro-. PCB 166. 1,1'-Biphenyl, 2,2',3,4,4',5-hexachloro-. 1,1'-Biphenyl, 2,2',3,3',4,4',5,5'-octachloro-.

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