Compound Identification
SMILES
CCC(=O)C[C@](O)(C1=CC=CC=C1)C(F)(F)F
InChIKey
InChIKey=QCVZPLFWQXHAKD-NSHDSACASA-N
Formula
C12H13F3O2
Mass
246.229
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzene and substituted derivatives
Alternative Parents
Beta-hydroxy ketones Tertiary alcohols Fluorohydrins Organofluorides Organic oxides Hydrocarbon derivatives Aromatic alcohols Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Monocyclic benzene moiety - Beta-hydroxy ketone - Tertiary alcohol - Ketone - Halohydrin - Fluorohydrin - Aromatic alcohol - Alcohol - Organooxygen compound - Organofluoride - Organohalogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
External Descriptors
Not available