2,2',3,3',4,4',5,5',6-Nonachlorobiphenyl
Synonyms: Nonachlorobiphenyl, "Nonachloro-1,1'-biphenyl", "2,2',3,3',4,4',5,5',6-nonachlorobiphenyl", "2,2',3,3',4,4',5,5',6-Nonachloro-1,1'-biphenyl", "1,2,3,4,5-pentachloro-6-(2,3,4,5-tetrachlorophenyl)benzene", "Nonachlorobiphenyl (mixed isomers)", "PCB No. 206".
Source: 2,2',3,3',4,4',5,5',6-Nonachlorobiphenyl is a member of the polychlorinated biphenyls (PCBs), a group of industrial chemicals used as dielectrics, coolants and lubricants in electrical equipment. PCBs contaminate water by leaching from landfills or other waste deposits.
Identifiers:
IUPAC Name: 1,2,3,4,5-pentachloro-6-(2,3,4,5-tetrachlorophenyl)benzene
CAS Number: 40186-72-9
PubChem ID: 38411
InChiKey: JFIMDKGRGPNPRQ-UHFFFAOYSA-N
Canonical SMILES: C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl
Structural Properties:
Molecular Formula: C12HCl9
Molecular Weight: 464,200
Pharmacophore Features:
Number of bond donors: 0
Number of bond acceptors: 0
Number of atoms different from hydrogen: 21
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Evidence Supporting This Chemical as an Emerging Contaminant
Mailler, R., Gasperi, J., Patureau, D., Vulliet, E., Delgenes, N., Danel, A., ... & Chebbo, G. (2017). Fate of emerging and priority micropollutants during the sewage sludge treatment: Case study of Paris conurbation. Part 1: Contamination of the different types of sewage sludge. Waste management, 59, 379-393.
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