Compound Identification
SMILES
[Cl-].[Cl-].CCCCCCCCCCCC[N+]1=CC=CC=C1.CCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1
InChIKey
InChIKey=ITJPEJPJPOLZMO-UHFFFAOYSA-L
Formula
C40H72Cl2N2
Mass
651.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Alkyldimethylbenzylammonium halides
Intermediate Tree Nodes
Not available
Direct Parent
Alkyldimethylbenzylammonium chlorides
Alternative Parents
Phenylmethylamines Benzylamines Aralkylamines Pyridinium derivatives Tetraalkylammonium salts Heteroaromatic compounds Azacyclic compounds Organic chloride salts Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Alkyldimethylbenzylammonium chloride - Benzylamine - Phenylmethylamine - Aralkylamine - Pyridinium - Pyridine - Heteroaromatic compound - Quaternary ammonium salt - Tetraalkylammonium salt - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic chloride salt - Organic salt - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyldimethylbenzylammonium chlorides. These are organic compounds consisting of a quaternary ammonium group substituted with a benzyl group, two methyl groups as well as an alkyl chain. These compounds also contain a chlorine ion and have the general structure R1[N+](CH3)(CH3)R2.[Cl-], where R1 = benzyl group and R2 = alkyl chain.
External Descriptors
Not available