Compound Identification
SMILES
FC1=CC=C(C=C1)N=CC1=CC=C(C=C1)N(CCI)CCI
InChIKey
InChIKey=BUDDKFDBGWXDQJ-UHFFFAOYSA-N
Formula
C17H17FI2N2
Mass
522.144
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
Dialkylarylamines Aniline and substituted anilines Fluorobenzenes Aryl fluorides Shiff bases Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Organoiodides Organofluorides Hydrocarbon derivatives Alkyl iodides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Nitrogen mustard - Halobenzene - Fluorobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Tertiary amine - Shiff base - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Aldimine - Organopnictogen compound - Hydrocarbon derivative - Organoiodide - Organofluoride - Organohalogen compound - Imine - Amine - Alkyl iodide - Alkyl halide - 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