Compound Identification
SMILES
[Al++]Cl.CC(O)CC(C)[N-]C1=C(C=CC=C1C(C)C)C(C)C.CC(O)CC(C)[N-]C1=C(C=CC=C1C(C)C)C(C)C
InChIKey
InChIKey=XYVHZJZQRIINTQ-UHFFFAOYSA-M
Formula
C34H56AlClN2O2
Mass
587.27
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 Secondary alcohols Organic metal halides Organonitrogen compounds Organic zwitterions Organic aluminium salts Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Phenylpropane - Cumene - Secondary alcohol - Organic metal halide - Organic metal salt - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic aluminium salt - Organic salt - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Alcohol - 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