Compound Identification
SMILES
CCC(=C)C(O)=O.NS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIKey
InChIKey=NODIEBPVULOKTG-UHFFFAOYSA-N
Formula
C13H10F17NO4S
Mass
599.26
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organohalogen compounds
-
Class
Alkyl halides
- Subclass Alkyl fluorides
-
Class
Alkyl halides
-
Superclass
Organohalogen compounds
Kingdom
Organic compounds
Superclass
Organohalogen compounds
Class
Alkyl halides
Subclass
Alkyl fluorides
Intermediate Tree Nodes
Perfluoroalkyl sulfonic acid and derivatives
Direct Parent
Perfluorooctane sulfonic acid and derivatives
Alternative Parents
Perfluoroalkyl sulfonamides Branched fatty acids Unsaturated fatty acids Organosulfonamides Organic sulfonamides Aminosulfonyl compounds Monocarboxylic acids and derivatives Carboxylic acids Organofluorides Organic oxides Organic nitrogen compounds Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Perfluorooctane sulfonic acid or derivatives - Perfluoroalkyl sulfonamide - Branched fatty acid - Organic sulfonic acid amide - Organosulfonic acid amide - Unsaturated fatty acid - Fatty acid - Fatty acyl - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organofluoride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as perfluorooctane sulfonic acid and derivatives. These are organic compounds containing an octyl chain attached to the sulfur of a sulfonic acid (or a derivative thereof), where all hydrogens of the octyl chain are replaced by fluorine atoms.
External Descriptors
Not available