decachlorobiphenyl

Synonyms: "decachloro-1,1'-biphenyl", "perchlorobiphenyl", "PCB 209"

Source: decachlorobiphenyl is a PCB (Polychlorinated biphenyl) which is considered an industrial pollutant.

Identifiers:

IUPAC Name: 1,2,3,4,5-pentachloro-6-(2,3,4,5,6-pentachlorophenyl)benzene
CAS Number: 2051-24-3
PubChem ID: 16318
InChiKey: ONXPZLFXDMAPRO-UHFFFAOYSA-N
Canonical SMILES: C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl

Structural Properties:

Molecular Formula: C12Cl10
Molecular Weight: 498,658

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 0
Number of atoms different from hydrogen: 22

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3D structure (.sdf)
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3D structure (.pdb)
3D structure (.pdbqt)

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Toxicological Information

ACToR (Aggregated Computational Toxicology Resource)

Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors


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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Keywords


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