Structure Information
Structure

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

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenols

Subclass

Nitrophenols

Intermediate Tree Nodes

Not available

Direct Parent

Dinitrophenols

Alternative Parents

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

Previous Back Next