Compound Identification
SMILES
[Fe].[CH-]1[CH-][CH-][CH-][CH-]1.C=CC(=O)[C-]1C=CC=C1
InChIKey
InChIKey=QYNMCODMVDAUJQ-UHFFFAOYSA-N
Formula
C13H12FeO
Mass
240.086
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
- Level 6 Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones
Direct Parent
Aryl ketones
Alternative Parents
Enones Aromatic hydrocarbons Acryloyl compounds Organic transition metal salts Enolates Unsaturated hydrocarbons Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Not available
Substituents
Aryl ketone - Aromatic hydrocarbon - Alpha,beta-unsaturated ketone - Enone - Acryloyl-group - Organic transition metal salt - Enolate - Unsaturated hydrocarbon - Organic oxide - Hydrocarbon derivative - Organic anion - Hydrocarbon - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl ketones. These are organic aromatic compounds that contain a ketone group substituted at one C-atom with an aryl group. They have the generic structure RC(=O)R', where R = aryl group and R'=organyl group.
External Descriptors
Not available