Compound Identification
SMILES
OC(=O)C1=CC=C(OS(O)(=O)=O)C=C1
InChIKey
InChIKey=RJTYSXVYCZAUHE-UHFFFAOYSA-N
Formula
C7H6O6S
Mass
218.18
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Organic sulfuric acids and derivatives
-
Subclass
Arylsulfates
- Level 5 Phenylsulfates
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Subclass
Arylsulfates
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Class
Organic sulfuric acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic sulfuric acids and derivatives
Subclass
Arylsulfates
Intermediate Tree Nodes
Not available
Direct Parent
Phenylsulfates
Alternative Parents
Benzoic acids Phenoxy compounds Benzoyl derivatives Sulfuric acid monoesters Monocarboxylic acids and derivatives Carboxylic acids Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylsulfate - Benzoic acid or derivatives - Benzoic acid - Phenoxy compound - Benzoyl - Sulfuric acid ester - Sulfate-ester - Sulfuric acid monoester - Monocyclic benzene moiety - Benzenoid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylsulfates. These are compounds containing a sulfuric acid group conjugated to a phenyl group.
External Descriptors
Not available