Compound Identification
SMILES
OCCC(C(O)=O)C(=O)C(F)(F)F
InChIKey
InChIKey=JMBHPVVNZWIAIH-UHFFFAOYSA-N
Formula
C6H7F3O4
Mass
200.113
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 Hydroxy fatty acids Branched fatty acids Beta-keto acids and derivatives Beta-hydroxy ketones 1,3-dicarbonyl compounds Alpha-haloketones Monocarboxylic acids and derivatives Carboxylic acids Primary alcohols Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Beta-keto acid - Branched fatty acid - Halogenated fatty acid - Hydroxy fatty acid - Short-chain keto acid - Beta-hydroxy ketone - Keto acid - 1,3-dicarbonyl compound - Alpha-haloketone - Ketone - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Primary alcohol - Alkyl fluoride - Carbonyl group - Organic oxygen compound - Alcohol - Organofluoride - Alkyl halide - Organohalogen compound - 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