Compound Identification
SMILES
[Zr++].OC1=CC=C(C=C1)C(F)(F)F.OC1=CC=C(C=C1)C(F)(F)F.CC1=C(C)C=C2C=C(CCC3=CC4=CC(C)=C(C)C=C4[CH-]3)[CH-]C2=C1
InChIKey
InChIKey=SKPJZBKRWJZFDT-UHFFFAOYSA-N
Formula
C38H34F6O2Zr
Mass
727.902
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
1-hydroxy-2-unsubstituted benzenoids Aromatic hydrocarbons Polycyclic hydrocarbons Organic transition metal salts Organic metal halides Unsaturated hydrocarbons Organooxygen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides Organic cations
Molecular Framework
Not available
Substituents
Trifluoromethylbenzene - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aromatic hydrocarbon - Polycyclic hydrocarbon - Organic metal halide - Organic transition metal salt - Alkyl fluoride - Alkyl halide - Organohalogen compound - Hydrocarbon derivative - Unsaturated hydrocarbon - Organic salt - Organic oxygen compound - Organooxygen compound - Organofluoride - Hydrocarbon - Organic cation - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors
Not available