Compound Identification
SMILES
[Na+].OCC1=CC(Cl)=CC=C1OCC([O-])=O
InChIKey
InChIKey=KJBSWAMTBIEBMP-UHFFFAOYSA-M
Formula
C9H8ClNaO4
Mass
238.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Phenoxyacetic acid derivatives
- Level 5 Chlorophenoxyacetates
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Subclass
Phenoxyacetic acid derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenoxyacetic acid derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Chlorophenoxyacetates
Alternative Parents
Phenoxy compounds Phenol ethers Benzyl alcohols Alkyl aryl ethers Chlorobenzenes Aryl chlorides Carboxylic acid salts Carboxylic acids Organic metal halides Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organic sodium salts Carbonyl compounds Organic zwitterions Organochlorides Aromatic alcohols Primary alcohols
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