Compound Identification
SMILES
CC(C)(O)C(F)(F)F.CC(C)(O)C(F)(F)F.CC(C)C1=CC=CC(C(C)C)=C1N=[Mo]=NCCC\C=C\C(C)(C)C
InChIKey
InChIKey=XTTBFMSKGTZJMI-VAMOKFDTSA-N
Formula
C29H48F6MoN2O2
Mass
666.66
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 Tertiary alcohols Fluorohydrins Organic transition metal salts Organonitrogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Not available
Substituents
Cumene - Phenylpropane - Tertiary alcohol - Halohydrin - Fluorohydrin - Organic transition metal salt - Alcohol - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - 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