Compound Identification
SMILES
[Ir].[CH]1[CH]CC[CH][CH]CC1.CC1=CC=CC=C1P(C1=CCC[C@@]11CCC=C1C1=N[C@H](CO1)C1=CC=CC=C1)C1=CC=CC=C1C.FC(F)(F)C1=CC(=CC(=C1)[B-](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(F)(F)F
InChIKey
InChIKey=XVKHLUCERRXPLM-JYWDITETSA-N
Formula
C72H56BF24IrNOP
Mass
1641.21
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
Toluenes Oxazolines Imidoesters Organic phosphines and derivatives Azacyclic compounds Oxacyclic compounds Cycloalkenes Organic metalloid salts Organic transition metal salts Alkyl fluorides Organofluorides Organometalloid compounds Organonitrogen compounds Organooxygen compounds Hydrocarbon derivatives Organopnictogen compounds Unsaturated aliphatic hydrocarbons Organic anions
Molecular Framework
Not available
Substituents
Trifluoromethylbenzene - Toluene - Oxazoline - Imido ester - Phosphine - Cyclic olefin - Cycloalkene - Organoheterocyclic compound - Organic transition metal salt - Organic metalloid salt - Azacycle - Oxacycle - Unsaturated hydrocarbon - Hydrocarbon derivative - Organic nitrogen compound - Unsaturated aliphatic hydrocarbon - Organopnictogen compound - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organic oxygen compound - Organic metalloid moeity - Organohalogen compound - Olefin - Alkyl fluoride - Alkyl halide - Hydrocarbon - Organic anion - Aromatic heteropolycyclic 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