Compound Identification
SMILES
OC(=O)C(O)=O.ClCCN(CCCl)CCP(=O)(CCCl)CCCl
InChIKey
InChIKey=WFRITJYOKPERJT-UHFFFAOYSA-N
Formula
C12H22Cl4NO5P
Mass
433.08
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
- Subclass Nitrogen mustard compounds
-
Class
Organonitrogen compounds
-
Superclass
Organic nitrogen compounds
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
Phosphorus mustard compounds Dicarboxylic acids and derivatives Organophosphine oxides Trialkylamines Carboxylic acids Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Not available
Substituents
Nitrogen mustard - Phosphorus mustard - Dicarboxylic acid or derivatives - Organophosphine oxide - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Organic oxide - Organooxygen compound - Organochloride - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Alkyl chloride - Carbonyl group - Amine - Alkyl halide - Organophosphorus compound - Hydrocarbon derivative - Aliphatic acyclic 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