Structure Information
Structure

Compound Identification

SMILES

CCC(CSC1=CC(C)=C(OCC(O)=O)C=C1)=C(C1=CC=C(C=C1)C1=CC(Cl)=CC(Cl)=C1)C1=CC=C(C=C1)C1=CC(Cl)=CC(Cl)=C1

InChIKey

InChIKey=QCTKDLRJHDNANE-UHFFFAOYSA-N

Formula

C38H30Cl4O3S

Mass

708.52

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Biphenyls and derivatives

Intermediate Tree Nodes

Chlorinated biphenyls

Direct Parent

Polychlorinated biphenyls

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Polychlorinated biphenyl - Diphenylmethane - Phenoxyacetate - Phenoxy compound - Aryl thioether - 1,3-dichlorobenzene - Phenol ether - Thiophenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Alkylarylthioether - Toluene - Aryl halide - Aryl chloride - Thioether - Sulfenyl compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carbonyl group - Organic oxygen compound - Organic oxide - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organooxygen compound - Organosulfur compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as polychlorinated biphenyls. These are organic compounds containing at least two chlorine atoms attached to either benzene ring of the biphenyl moiety.

External Descriptors

Not available

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