Compound Identification
SMILES
CC(=O)C1=NC=CC(OS(=O)(=O)C(F)(F)F)=N1
InChIKey
InChIKey=SAVUHVFRLCTLOS-UHFFFAOYSA-N
Formula
C7H5F3N2O4S
Mass
270.18
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Organic sulfonic acids and derivatives
-
Subclass
Organosulfonic acids and derivatives
-
Level 5
Alkanesulfonic acids and derivatives
-
Level 6
Alkanesulfonic acids
- Level 7 Trifluoromethanesulfonates
-
Level 6
Alkanesulfonic acids
-
Level 5
Alkanesulfonic acids and derivatives
-
Subclass
Organosulfonic acids and derivatives
-
Class
Organic sulfonic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic sulfonic acids and derivatives
Subclass
Organosulfonic acids and derivatives
Intermediate Tree Nodes
Alkanesulfonic acids and derivatives - Alkanesulfonic acids
Direct Parent
Trifluoromethanesulfonates
Alternative Parents
Aryl alkyl ketones Sulfonic acid esters Pyrimidines and pyrimidine derivatives Organosulfonic acid esters Sulfonyls Methanesulfonates Heteroaromatic compounds Trihalomethanes Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethanesulfonate - Aryl alkyl ketone - Aryl ketone - Pyrimidine - Sulfonic acid ester - Organosulfonic acid ester - Methanesulfonate - Heteroaromatic compound - Sulfonyl - Ketone - Trihalomethane - Azacycle - Organoheterocyclic compound - Alkyl fluoride - Hydrocarbon derivative - Halomethane - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethanesulfonates. These are alkanesulfonic acids, that contain a sulfonate group that is substituted with a trifluoromethyl group.
External Descriptors
Not available