Compound Identification
SMILES
CC(=O)C(C(SCCO)C1=CC=CC=C1)C(C)=O
InChIKey
InChIKey=OBPAKOPMWFJXRU-UHFFFAOYSA-N
Formula
C14H18O3S
Mass
266.36
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
1,3-dicarbonyl compounds
- Level 6 Beta-diketones
-
Level 5
1,3-dicarbonyl compounds
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
1,3-dicarbonyl compounds
Direct Parent
Beta-diketones
Alternative Parents
Benzene and substituted derivatives Ketones Sulfenyl compounds Dialkylthioethers Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
1,3-diketone - Benzenoid - Monocyclic benzene moiety - Ketone - Dialkylthioether - Sulfenyl compound - Thioether - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organosulfur compound - Alcohol - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta-diketones. These are organic compounds containing two keto groups separated by a single carbon atom.
External Descriptors
Not available