Structure Information
Structure

Compound Identification

SMILES

OC1=CC=C(C=C1)N(CCBr)CCBr

InChIKey

InChIKey=SVMALHWUCBPBFC-UHFFFAOYSA-N

Formula

C10H13Br2NO

Mass

323.028

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic nitrogen compounds

Class

Organonitrogen compounds

Subclass

Nitrogen mustard compounds

Intermediate Tree Nodes

Not available

Direct Parent

Nitrogen mustard compounds

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

P-aminophenol - Aminophenol - Nitrogen mustard - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Benzenoid - Tertiary amine - Organopnictogen compound - Alkyl halide - Organooxygen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Alkyl bromide - Amine - Hydrocarbon derivative - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitrogen mustard compounds. These are compounds having two beta-haloalkyl groups bound to a nitrogen atom.

External Descriptors

Not available

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