Compound Identification
SMILES
COC(=O)COC(=O)C(=C)C#N
InChIKey
InChIKey=FDJYGWPTJQDPLY-UHFFFAOYSA-N
Formula
C7H7NO4
Mass
169.136
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Carboxylic acid derivatives
-
Level 5
Carboxylic acid esters
-
Level 6
Alpha,beta-unsaturated carboxylic esters
-
Level 7
Enoate esters
- Level 8 Cyanoacrylates
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Level 7
Enoate esters
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Level 6
Alpha,beta-unsaturated carboxylic esters
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Level 5
Carboxylic acid esters
-
Subclass
Carboxylic acid derivatives
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Carboxylic acid derivatives
Intermediate Tree Nodes
Carboxylic acid esters - Alpha,beta-unsaturated carboxylic esters - Enoate esters
Direct Parent
Cyanoacrylates
Alternative Parents
Dicarboxylic acids and derivatives Methyl esters Nitriles Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Cyanoacrylic acid ester - Dicarboxylic acid or derivatives - Methyl ester - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as cyanoacrylates. These are organonitrogen compounds containing an acrylic acid ester, which carries a nitrile group. They have the general structure ROC(=O)C(=C)C#N, where R is an organic group.
External Descriptors
Not available