Structure Information
Structure

Compound Identification

SMILES

CC(=O)C1COC(=O)C1=O

InChIKey

InChIKey=NILJTCCLWYQQST-UHFFFAOYSA-N

Formula

C6H6O4

Mass

142.11

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Taxonomic Classification

Taxonomy Tree

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

Gamma butyrolactones Furanones Oxolanes Cyclic ketones Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Aldehydes

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

1,3-diketone - 3-furanone - Gamma butyrolactone - Oxolane - Cyclic ketone - Lactone - Ketone - Carboxylic acid ester - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Organic oxide - Aldehyde - Hydrocarbon derivative - Aliphatic heteromonocyclic 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

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