6,7-dichloro-3-dibenzofuranol

Synonyms: "6,7-dichloro-3-dibenzofuranol", "7-hydroxy-3,4-dichlorodibenzofuran", "6,7-dichlorodibenzo[b,d]furan-3-ol".

Source: 6,7-dichloro-3-dibenzofuranol is a hydroxylated metabolite of polichlorinated dibenzofurans (PCDFs).

Identifiers:

IUPAC Name: 6,7-dichlorodibenzofuran-3-ol
CAS Number: 328896-40-8
PubChem ID: 11954132
InChiKey: KDDOMWMUWCVKBL-UHFFFAOYSA-N
Canonical SMILES: C1=CC2=C(C=C1O)OC3=C2C=CC(=C3Cl)Cl

Structural Properties:

Molecular Formula: C12H6Cl2O2
Molecular Weight: 253.078

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 2
Number of atoms different from hydrogen: 16

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Nishihara T, Nishikawa J, Kanayama T, Dakeyama F, Saito K, Imagawa M, Takatori S, Kitagawa Y, Hori S, Utsumi H. 2000. Estrogenic activities of 517 chemicals by yeast two-hybrid assay. Journal of Health Science 46(4):282-298. DOI: 10.1248/jhs.46.282. URL: https://www.jstage.jst.go.jp/article/jhs1999/46/4/46_4_282/_article.

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