Compound Identification
SMILES
CO[C@]12O[C@@H]3C[C@H]1C[C@H](C[C@H]2Cl)C3=O
InChIKey
InChIKey=KNVPLUOFMLAPEU-PZACJGDYSA-N
Formula
C10H13ClO3
Mass
216.66
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Oxepanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Oxepanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Oxepanes
Alternative Parents
Ketals Oxolanes Ketones Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides Aldehydes
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Ketal - Oxepane - Oxolane - Ketone - Acetal - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Organic oxide - Carbonyl group - Alkyl halide - Alkyl chloride - Aldehyde - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as oxepanes. These are compounds containing an oxepane ring, which is a seven-member saturated aliphatic heterocycle with one oxygen and six carbon atoms.
External Descriptors
Not available