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3,3',4,4',5,5'-Hexachlorobiphenyl
[CAS# 32774-16-6]

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Identification
Classification Analytical chemistry >> Food safety >> Dioxins, polychlorinated biphenyls, furans
Name 3,3',4,4',5,5'-Hexachlorobiphenyl
Synonyms Polychlorinated Biphenyls (Pcbs); 1,1'-Biphenyl, 3,3',4,4',5,5'-Hexachloro-; 1,1'-Biphenyl, 3,3',4,4',5,5'-Hexachloro- (9Ci)
Molecular Structure CAS#: 32774-16-6, 3,3',4,4',5,5'-Hexachlorobiphenyl
Molecular Formula C12H4Cl6
Molecular Weight 360.88
CAS Registry Number 32774-16-6
SMILES C1=C(C(=C(C=C1C2=CC(=C(C(=C2)Cl)Cl)Cl)Cl)Cl)Cl
InChI 1S/C12H4Cl6/c13-7-1-5(2-8(14)11(7)17)6-3-9(15)12(18)10(16)4-6/h1-4H
InChIKey ZHLICBPIXDOFFG-UHFFFAOYSA-N
Properties
Density 1.594g/cm3 (Cal.)
Boiling point 436.636°C at 760 mmHg (Cal.)
Flash point 223.145°C (Cal.)
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