Compound Identification
SMILES
C[C@]12COC[C@H](O1)[C@H](O2)C1=CC=CC=C1
InChIKey
InChIKey=UTOBNQQNSQVXJM-TUAOUCFPSA-N
Formula
C12H14O3
Mass
206.241
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Dioxepanes
- Subclass 1,4-dioxepanes
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Class
Dioxepanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Dioxepanes
Subclass
1,4-dioxepanes
Intermediate Tree Nodes
Not available
Direct Parent
1,4-dioxepanes
Alternative Parents
Ketals Benzene and substituted derivatives 1,4-dioxanes 1,3-dioxolanes Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Ketal - 1,4-dioxepane - Benzenoid - Monocyclic benzene moiety - Para-dioxane - Meta-dioxolane - Oxacycle - Ether - Dialkyl ether - Acetal - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-dioxepanes. These are dioxepanes with the two ring oxygen atoms at position 1 and 4, respectively.
External Descriptors
Not available