4'-bromo-2,3,4,5-tetrachloro-1,1'-biphenyl

Synonyms: "4'-bromo-2,3,4,5-tetrachlorobiphenyl", "1-(4-bromophenyl)-2,3,4,5-tetrachlorobenzene".

Source: 4'-bromo-2,3,4,5-tetrachlorobiphenyl is a mixed bromo-chloro biphenyls, which may be generated by processing and combustion of electrical equipment and electrical components.

Identifiers:

IUPAC Name: 1-(4-bromophenyl)-2,3,4,5-tetrachlorobenzene
CAS Number: 82845-25-8
PubChem ID: 158264
InChiKey: DIWVWXQAIZHGHT-UHFFFAOYSA-N
Canonical SMILES: C1=CC(=CC=C1C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)Br

Structural Properties:

Molecular Formula: C₁₂H₅BrCl₄
Molecular Weight: 370.876

Pharmacophore Features:

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

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TEDX List of Potential Endocrine Disruptors

Bandiera S, Sawyer TW, Campbell MA, Fujita T, Safe S. 1983. Competitive binding to the cytosolic 2,3,7,8-tetrachlorodibenzo-p-dioxin receptor. Effects of structure on the affinities of substituted halogenated biphenyls--a QSAR analysis. Biochem Pharmacol 32(24):3803-3813. DOI: 10.1016/0006-2952(83)90153-3. URL: https://www.sciencedirect.com/science/article/pii/0006295283901533.