Compound Identification
SMILES
OC1=C(OS(O)(=O)=O)C(Br)=C(Br)C(COS(O)(=O)=O)=C1Br
InChIKey
InChIKey=BGWXDFAPVMVNQK-UHFFFAOYSA-N
Formula
C7H5Br3O9S2
Mass
536.94
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Organic sulfuric acids and derivatives
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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
Phenoxy compounds P-bromophenols O-bromophenols M-bromophenols Bromobenzenes Sulfuric acid monoesters Aryl bromides Alkyl sulfates Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylsulfate - Phenoxy compound - 4-halophenol - 3-halophenol - 2-halophenol - 3-bromophenol - 2-bromophenol - 4-bromophenol - Bromobenzene - Halobenzene - Phenol - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Sulfuric acid ester - Alkyl sulfate - Sulfate-ester - Sulfuric acid monoester - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organooxygen compound - 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