Structure Information
Structure

Compound Identification

SMILES

[Na+].OCC1=CC(Cl)=CC=C1OCC([O-])=O

InChIKey

InChIKey=KJBSWAMTBIEBMP-UHFFFAOYSA-M

Formula

C9H8ClNaO4

Mass

238.6

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenoxyacetic acid derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Chlorophenoxyacetates

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Chlorophenoxyacetate - Phenoxy compound - Benzyl alcohol - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Carboxylic acid salt - Organic metal halide - Organic alkali metal salt - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Alcohol - Organohalogen compound - Organochloride - Organooxygen compound - Primary alcohol - Aromatic alcohol - Organic zwitterion - Organic salt - Carbonyl group - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as chlorophenoxyacetates. These are compounds containing a phenoxyacetate that carries one or more chlorine atoms on the benzene ring.

External Descriptors

CHEBI:81983 : organic molecular entity
KEGG (C18819) : Pesticides

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