2,3,4,5,6-pentachlorobiphenyl

Synonyms: "pyralene 1476", "pyroclor 5", "pentachlorodiphenyl", "kanekrol 500", "diphenyl pentachloride", "apirolio 1476 C"

Source: 2,3,4,5,6-pentachlorobiphenyl 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-phenylbenzene
CAS Number: 18259-05-7
PubChem ID: 17348
InChiKey: GGMPTLAAIUQMIE-UHFFFAOYSA-N
Canonical SMILES: C1=CC=C(C=C1)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl

Structural Properties:

Molecular Formula: C12H5Cl5
Molecular Weight: 326.433

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 0
Number of atoms different from hydrogen: 17

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors
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Soto AM, Sonnenschein C, Chung KL, Fernandez MF, Olea N, Serrano FO. 1995. The E-SCREEN assay as a tool to identify estrogens: An update on estrogenic environmental pollutants. Environ Health Perspect 103 (Suppl. 7):113-122.

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