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Structure Information
Structure

Compound Identification

SMILES

[Al+3].NC1=C(Cl)C(=CC(Cl)=C1)C([O-])=O.NC1=C(Cl)C(=CC(Cl)=C1)C([O-])=O.NC1=C(Cl)C(=CC(Cl)=C1)C([O-])=O

InChIKey

InChIKey=QJYBQRLDTDYEQU-UHFFFAOYSA-K

Formula

C21H12AlCl6N3O6

Mass

642.02

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Benzoic acids

Direct Parent

Dichlorobenzoic acids

Alternative Parents

Molecular Framework

Not available

Substituents

2,5-dichlorobenzoic acid - Aminobenzoic acid - 2-halobenzoic acid or derivatives - Aminobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 2-halobenzoic acid - 3-halobenzoic acid - Halobenzoic acid - 1,4-dichlorobenzene - 1-carboxy-2-haloaromatic compound - Aniline or substituted anilines - Benzoyl - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Vinylogous halide - Amino acid - Amino acid or derivatives - Carboxylic acid salt - Organic metal halide - Carboxylic acid - Carboxylic acid derivative - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Primary amine - Organic zwitterion - Organic salt - Organic aluminium salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as dichlorobenzoic acids. These are benzoic acids having two chlorine atoms attached to the carboxylated benzene ring.

External Descriptors

Not available

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