Compound Identification
SMILES
OC1=C(C=CC=O)C=C(Cl)C=C1
InChIKey
InChIKey=TWBSLXPPYNMYNJ-UHFFFAOYSA-N
Formula
C9H7ClO2
Mass
182.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Cinnamaldehydes
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamaldehydes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamaldehydes
Alternative Parents
Styrenes P-chlorophenols Chlorobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Enals Organochlorides Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamaldehyde - 4-halophenol - 4-chlorophenol - Styrene - Chlorobenzene - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Phenol - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Enal - Alpha,beta-unsaturated aldehyde - Organooxygen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Aldehyde - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamaldehydes. These are organic aromatic compounds containing a cinnamlaldehyde moiety, consisting of a benzene and an aldehyde group to form 3-phenylprop-2-enal.
External Descriptors
Not available