Compound Identification
SMILES
C[S+](C)C1=CC=C(C#N)C2=CC=CC=C12.[O-]S(=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=RTZXNLLNTDIRET-UHFFFAOYSA-M
Formula
C21H12F17NO3S2
Mass
713.42
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
Naphthalenes Sulfonyls Organosulfonic acids Alkanesulfonic acids Nitriles Organofluorides Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Perfluorooctane sulfonic acid or derivatives - Naphthalene - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Alkanesulfonic acid - Sulfonyl - Carbonitrile - Nitrile - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organonitrogen compound - Organofluoride - Cyanide - Organic cation - Aromatic homopolycyclic 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