Compound Identification
SMILES
[Na+].OC1=C(C=C(C=C1N\N=C1\C(=O)C=CC2=C1C=CC(=C2)S([O-])(=O)=O)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=BUYOCVPXZKTJSV-FLNCGGNMSA-M
Formula
C16H9N4NaO9S
Mass
456.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenols
-
Subclass
Nitrophenols
- Level 5 Dinitrophenols
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Subclass
Nitrophenols
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Class
Phenols
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenols
Subclass
Nitrophenols
Intermediate Tree Nodes
Not available
Direct Parent
Dinitrophenols
Alternative Parents
Naphthalenes Nitrobenzenes 1-sulfo,2-unsubstituted aromatic compounds Phenylhydrazines Nitroaromatic compounds Sulfonyls Organosulfonic acids Cyclic ketones Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrazones Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Dinitrophenol - Naphthalene - Arylsulfonic acid or derivatives - Nitrobenzene - 1-sulfo,2-unsubstituted aromatic compound - Nitroaromatic compound - Phenylhydrazine - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Cyclic ketone - Ketone - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic alkali metal salt - Propargyl-type 1,3-dipolar organic compound - Hydrazone - Organic oxoazanium - Organic sodium salt - Organic salt - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic cation - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as dinitrophenols. These are organic aromatic compounds containing a benzene that carries a single phenol group and exactly two nitro groups.
External Descriptors
Not available