Compound Identification
SMILES
CNCCC1=CC(Br)=C(O)C=C1
InChIKey
InChIKey=AINJSQXLMHMVIX-UHFFFAOYSA-N
Formula
C9H12BrNO
Mass
230.105
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenethylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenethylamines
Alternative Parents
O-bromophenols Bromobenzenes Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Aryl bromides Dialkylamines Organopnictogen compounds Organooxygen compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenethylamine - 2-halophenol - 2-bromophenol - 1-hydroxy-2-unsubstituted benzenoid - Bromobenzene - Halobenzene - Aralkylamine - Phenol - Aryl bromide - Aryl halide - Secondary aliphatic amine - Secondary amine - Organohalogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organobromide - Organonitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenethylamines. These are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine.
External Descriptors
CHEBI:69058 : primary amine