Compound Identification
SMILES
CCC(Br)C(=O)C1(CC1)C(O)=O
InChIKey
InChIKey=HZUWRNQHMDMWDB-UHFFFAOYSA-N
Formula
C8H11BrO3
Mass
235.077
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
Halogenated fatty acids Beta-keto acids and derivatives Cyclopropanecarboxylic acids Beta-hydroxy ketones Alpha-haloketones Monocarboxylic acids and derivatives Carboxylic acids Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Medium-chain keto acid - Beta-keto acid - Halogenated fatty acid - Beta-hydroxy ketone - Fatty acyl - Cyclopropanecarboxylic acid - Cyclopropanecarboxylic acid or derivatives - Alpha-haloketone - Ketone - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Alkyl bromide - Organohalogen compound - Organobromide - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Alkyl halide - Aliphatic homomonocyclic 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