Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@H]1[C@]2(Cl)C(Cl)=C(Cl)[C@]3(Cl)[C@@]1(Br)C(=O)O[C@]23OC

InChIKey

InChIKey=YKQXHXYYVQUMAT-PWXXUDCKSA-N

Formula

C11H7BrCl4O5

Mass

440.88

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactones

Subclass

Delta valerolactones

Intermediate Tree Nodes

Not available

Direct Parent

Delta valerolactones

Alternative Parents

Ketals Dicarboxylic acids and derivatives Gamma butyrolactones Oxanes Oxolanes Methyl esters Oxacyclic compounds Vinyl chlorides Chloroalkenes Organic oxides Alkyl chlorides Hydrocarbon derivatives Alkyl bromides Carbonyl compounds Organobromides Organochlorides

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Ketal - Delta valerolactone - Delta_valerolactone - Dicarboxylic acid or derivatives - Gamma butyrolactone - Oxane - Methyl ester - Oxolane - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Oxacycle - Chloroalkene - Haloalkene - Vinyl halide - Vinyl chloride - Alkyl chloride - Alkyl bromide - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organobromide - Organochloride - Organooxygen compound - Alkyl halide - Carbonyl group - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as delta valerolactones. These are cyclic organic compounds containing an oxan-2- one moiety.

External Descriptors

Not available

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