Compound Identification
SMILES
[O-]S(=O)(=O)C(F)(F)F.COC(=O)CC[S+](CCC(=O)OC)C1=CC=C(C)C=C1
InChIKey
InChIKey=ZWSIZZPOJJHQHW-UHFFFAOYSA-M
Formula
C16H21F3O7S2
Mass
446.45
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
Toluenes Dicarboxylic acids and derivatives Sulfonyls Organosulfonic acids Methyl esters Methanesulfonates Trihalomethanes Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organic cations
Molecular Framework
Not available
Substituents
Trifluoromethanesulfonate - Toluene - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Methanesulfonate - Organosulfonic acid - Sulfonyl - Methyl ester - Carboxylic acid ester - Trihalomethane - Carboxylic acid derivative - Halomethane - Organosulfur compound - Organooxygen compound - Organofluoride - Organohalogen compound - Alkyl halide - Organic oxide - Alkyl fluoride - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic cation - Aromatic homomonocyclic 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