Compound Identification
SMILES
COC(=O)C(=C1\OC2=C(S1)C=C1OCOC1=C2)\C(F)(F)F
InChIKey
InChIKey=GKOGIBVIGYQYIH-PKNBQFBNSA-N
Formula
C12H7F3O5S
Mass
320.24
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxathioles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxathioles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxathioles
Alternative Parents
Benzodioxoles Aryl thioethers Vinylogous thioesters Benzenoids Vinylogous esters Monothioacetals Enoate esters Methyl esters Ketene acetals Monocarboxylic acids and derivatives Oxacyclic compounds Acetals Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Benzoxathiole - Aryl thioether - Vinylogous thioester - Benzenoid - Vinylogous ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Monothioacetal - Carboxylic acid ester - Ketene acetal or derivatives - Acetal - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxygen compound - Organohalogen compound - Organofluoride - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxathioles. These are organic compounds containing a benzene fused to an oxathiole ring (a five-membered ring with four carbon atoms, one oxygen atom, and one sulfur atom).
External Descriptors
Not available