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2,2',3,3',4,4'-Hexachlorobiphenyl
[CAS# 38380-07-3]

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Identification
Name 2,2',3,3',4,4'-Hexachlorobiphenyl
Synonyms Aroclor 1260; 1,1'-Biphenyl, 2,2',3,3',4,4'-Hexachloro-; 2,2',3,3',4,4'-Hexachlorobiphenyl
Molecular Structure CAS#: 38380-07-3, 2,2',3,3',4,4'-Hexachlorobiphenyl
Molecular Formula C12H4Cl6
Molecular Weight 360.88
CAS Registry Number 38380-07-3
SMILES C2=C(C1=CC=C(C(=C1Cl)Cl)Cl)C(=C(C(=C2)Cl)Cl)Cl
InChI 1S/C12H4Cl6/c13-7-3-1-5(9(15)11(7)17)6-2-4-8(14)12(18)10(6)16/h1-4H
InChIKey BTAGRXWGMYTPBY-UHFFFAOYSA-N
Properties
Density 1.594g/cm3 (Cal.)
Boiling point 403.809°C at 760 mmHg (Cal.)
Flash point 198.85°C (Cal.)
References
(1) Igor V. Tetko, Vsevolod Yu. Tanchuk, Tamara N. Kasheva, and Alessandro E. P. Villa. Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices, J. Chem. Inf. Comput. Sci., 2001, 41 (6), pp 1488–1493
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List of Reports Available for 2,2',3,3',4,4'-Hexachlorobiphenyl
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