Compound Identification
SMILES
C(C1OC=CC=CO1)C1=CC=CC=C1
InChIKey
InChIKey=MRQVEHGEZPAVRP-UHFFFAOYSA-N
Formula
C12H12O2
Mass
188.226
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Dioxepines
- Subclass 1,3-dioxepines
-
Class
Dioxepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Dioxepines
Subclass
1,3-dioxepines
Intermediate Tree Nodes
Not available
Direct Parent
1,3-dioxepines
Alternative Parents
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1,3-dioxepine - Benzenoid - Monocyclic benzene moiety - Oxacycle - Acetal - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3-dioxepines. These are dioxepines with the two ring oxygen atoms at position 1 and 3, respectively.
External Descriptors
Not available