Compound Identification
SMILES
OC(=O)C(I)=CC(=CC(I)=O)C#N
InChIKey
InChIKey=PYMQADWUXSFECS-UHFFFAOYSA-N
Formula
C7H3I2NO3
Mass
402.914
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Medium-chain 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
Medium-chain fatty acids
Alternative Parents
Halogenated fatty acids Branched fatty acids Unsaturated fatty acids Alpha-halocarboxylic acids Vinyl iodides Nitriles Monocarboxylic acids and derivatives Iodoalkenes Carboxylic acids Acyl iodides Organopnictogen compounds Organoiodides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Medium-chain fatty acid - Branched fatty acid - Halogenated fatty acid - Unsaturated fatty acid - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Acyl halide - Acyl iodide - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Vinyl halide - Vinyl iodide - Iodoalkene - Haloalkene - Organopnictogen compound - Carbonyl group - Organohalogen compound - Organoiodide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.
External Descriptors
Not available