Compound Identification
SMILES
OO.CC(C)C1=CC=CC=C1.C1CCC(CC1)C1=CC=CC=C1
InChIKey
InChIKey=SXGZTCGHYQWIJD-UHFFFAOYSA-N
Formula
C21H30O2
Mass
314.469
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Cumenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Cumenes
Intermediate Tree Nodes
Not available
Direct Parent
Cumenes
Alternative Parents
Phenylpropanes Aromatic hydrocarbons Unsaturated hydrocarbons Organic oxygen compounds Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Phenylpropane - Cumene - Aromatic hydrocarbon - Organic oxygen compound - Unsaturated hydrocarbon - Hydrocarbon derivative - Hydrocarbon - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cumenes. These are aromatic compounds containing a prop-2-ylbenzene moiety.
External Descriptors
Not available