Compound Identification
SMILES
[Br-].C[N+](C)(C)CC1=CC=CC=C1CO
InChIKey
InChIKey=ZWEYMDFCTUMTFL-UHFFFAOYSA-M
Formula
C11H18BrNO
Mass
260.175
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 halides
Alternative Parents
Phenylmethylamines Benzylamines Benzyl alcohols Aralkylamines Tetraalkylammonium salts Primary alcohols Organic zwitterions Organic bromide salts Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyldimethylbenzylammonium halide - Benzyl alcohol - Benzylamine - Phenylmethylamine - Aralkylamine - Tetraalkylammonium salt - Quaternary ammonium salt - Alcohol - Organic salt - Organic zwitterion - Aromatic alcohol - Organic bromide salt - Primary alcohol - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyldimethylbenzylammonium halides. 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 halogen ion and have the general structure R1[N+](CH3)(CH3)R2.[X-], where R1 = benzyl group, R2 = alkyl chain, and X = halogen atom.
External Descriptors
Not available