Compound Identification
SMILES
OC(=O)C(=O)C(\Cl)=C(/Cl)CCl
InChIKey
InChIKey=FSEJSMRIJGKOCM-NSCUHMNNSA-N
Formula
C5H3Cl3O3
Mass
217.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Halogenated fatty acids
-
Subclass
Fatty acids and conjugates
-
Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Fatty acids and conjugates
Intermediate Tree Nodes
Not available
Direct Parent
Halogenated fatty acids
Alternative Parents
Short-chain keto acids and derivatives Alpha-branched alpha,beta-unsaturated ketones Alpha-keto acids and derivatives Unsaturated fatty acids Acryloyl compounds Vinylogous halides Alpha-chloroketones Alpha-hydroxy ketones Enones Chloroalkenes Carboxylic acids Vinyl chlorides Monocarboxylic acids and derivatives Alkyl chlorides Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Halogenated fatty acid - Short-chain keto acid - Alpha-keto acid - Alpha-branched alpha,beta-unsaturated-ketone - Keto acid - Unsaturated fatty acid - Alpha-haloketone - Alpha-chloroketone - Acryloyl-group - Alpha-hydroxy ketone - Enone - Vinylogous halide - Alpha,beta-unsaturated ketone - Ketone - Carboxylic acid derivative - Carboxylic acid - Chloroalkene - Haloalkene - Vinyl halide - Vinyl chloride - Monocarboxylic acid or derivatives - Alkyl chloride - Organic oxygen compound - Alkyl halide - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organohalogen compound - Organochloride - Organooxygen compound - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as halogenated fatty acids. These are fatty acids with a chain that carries a halogen atom (Cl,F,I,Br).
External Descriptors
Not available