Compound Identification
SMILES
CC(OO)\C=C\C=O
InChIKey
InChIKey=LBZOSNWDIMPSPY-NSCUHMNNSA-N
Formula
C5H8O3
Mass
116.116
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Alpha,beta-unsaturated carbonyl compounds
-
Level 6
Alpha,beta-unsaturated aldehydes
- Level 7 Enals
-
Level 6
Alpha,beta-unsaturated aldehydes
-
Level 5
Alpha,beta-unsaturated carbonyl 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
Alpha,beta-unsaturated carbonyl compounds - Alpha,beta-unsaturated aldehydes
Direct Parent
Enals
Alternative Parents
Allylic hydroperoxides Peroxols Alkyl hydroperoxides Short-chain aldehydes Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic acyclic compounds
Substituents
Allylic hydroperoxide - Enal - Hydroperoxide - Alkyl hydroperoxide - Peroxol - Organic oxide - Hydrocarbon derivative - Short-chain aldehyde - Aldehyde - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as enals. These are an alpha,beta-unsaturated aldehyde of general formula RC=C-CH=O in which the aldehydic C=O function is conjugated to a C=C triple bond at the alpha,beta position.
External Descriptors
Not available