Compound Identification
SMILES
CC(=O)C1=C(O)S\C(=C/C2=CC=C(C=C2)C(F)(F)F)C1=O
InChIKey
InChIKey=NFRBZIHBWOTPOK-POHAHGRESA-N
Formula
C14H9F3O3S
Mass
314.28
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
Vinylogous thioesters Vinylogous acids Dihydrothiophenes Thioenol ethers Ketene acetals Cyclic ketones Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Vinylogous thioester - 2,3-dihydrothiophene - Vinylogous acid - Ketene acetal or derivatives - Ketone - Thioenolether - Cyclic ketone - Organoheterocyclic compound - Organooxygen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic 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