Compound Identification
SMILES
OC(=O)C=CC(=O)C(Cl)C(O)=O
InChIKey
InChIKey=SCSZJXOTAAUHEL-UHFFFAOYSA-N
Formula
C6H5ClO5
Mass
192.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Keto acids and derivatives
Subclass
Medium-chain keto acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Medium-chain keto acids and derivatives
Alternative Parents
b'-hydroxy-alpha,beta-unsaturated ketones Beta-keto acids and derivatives Halogenated fatty acids Unsaturated fatty acids 1,3-dicarbonyl compounds Beta-hydroxy ketones Dicarboxylic acids and derivatives Acryloyl compounds Alpha-chloroketones Alpha-halocarboxylic acids Enones Carboxylic acids Alkyl chlorides Organic oxides Hydrocarbon derivatives Organochlorides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Medium-chain keto acid - Beta-keto acid - Halogenated fatty acid - B'-hydroxy-alpha,beta-unsaturated-ketone - Beta-hydroxy ketone - Dicarboxylic acid or derivatives - Fatty acyl - Unsaturated fatty acid - 1,3-dicarbonyl compound - Acryloyl-group - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Alpha-haloketone - Alpha-chloroketone - Enone - Alpha,beta-unsaturated ketone - Ketone - Carboxylic acid - Carboxylic acid derivative - Alkyl chloride - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organooxygen compound - Alkyl halide - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as medium-chain keto acids and derivatives. These are keto acids with a 6 to 12 carbon atoms long side chain.
External Descriptors
Not available