1,3,6-trichlorodibenzofuran

Synonyms: "1,3,6-trichloro-dibenzofuran"

Source: 1,3,6-trichlorodibenzofuran is one of the polychlorinated dibenzofurans (PCDFs), which are ubiquitous environmental contaminants, usually formed as byproducts of the production and use of polychlorinated biphenyls (PCBs).

Identifiers:

IUPAC Name: 1,3,6-trichlorodibenzofuran
CAS Number: 83704-39-6
PubChem ID: 55119
InChiKey: AGPTXRLVBIRYLV-UHFFFAOYSA-N
Canonical SMILES: C1=CC2=C(C(=C1)Cl)OC3=CC(=CC(=C23)Cl)Cl

Structural Properties:

Molecular Formula: C12H5Cl3O
Molecular Weight: 271.527

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 0
Number of atoms different from hydrogen: 16

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors
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Bandiera S, Sawyer T, Romkes M, Zmudzka B, Safe L, Mason G, Keys B, Safe S. 1984. Polychlorinated dibenzofurans (PCDFs): effects of structure on binding to the 2,3,7,8-TCDD cytosolic receptor protein, AHH induction and toxicity. Toxicology 32(2):131-144.

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