Structure Information
Structure

Compound Identification

SMILES

CC(NC1=C(C=C(C)C=C1[N+]([O-])=O)[N+]([O-])=O)C(Cl)=O

InChIKey

InChIKey=JIXNDDQVMPQRHD-UHFFFAOYSA-N

Formula

C10H10ClN3O5

Mass

287.66

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Toluenes

Intermediate Tree Nodes

Nitrotoluenes

Direct Parent

Dinitrotoluenes

Alternative Parents

Dinitroanilines Alanine and derivatives Nitrobenzenes Phenylalkylamines Aminotoluenes Nitroaromatic compounds Secondary alkylarylamines Propargyl-type 1,3-dipolar organic compounds Acyl chlorides Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic salts Organic zwitterions Organochlorides

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Dinitrotoluene - Dinitroaniline - Alanine or derivatives - Alpha-amino acid or derivatives - Nitrobenzene - Nitroaromatic compound - Aminotoluene - Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - C-nitro compound - Organic nitro compound - Acyl chloride - Acyl halide - Organic oxoazanium - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organic nitrogen compound - Organohalogen compound - Organic oxide - Hydrocarbon derivative - Amine - Organic zwitterion - Carbonyl group - Organic oxygen compound - Organic salt - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as dinitrotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group and exactly two nitro groups.

External Descriptors

Not available

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