Compound Identification
SMILES
OC1=C(Br)C=C(Cl)C=C1C(=O)\C=C\C1=CC=C(C=C1)C(F)(F)F
InChIKey
InChIKey=VZQIONPQLPDDIX-ZZXKWVIFSA-N
Formula
C16H9BrClF3O2
Mass
405.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 2'-Hydroxychalcones
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Subclass
Chalcones and dihydrochalcones
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Class
Linear 1,3-diarylpropanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Linear 1,3-diarylpropanoids
Subclass
Chalcones and dihydrochalcones
Intermediate Tree Nodes
Not available
Direct Parent
2'-Hydroxychalcones
Alternative Parents
Cinnamylphenols Cinnamic acids and derivatives Trifluoromethylbenzenes Styrenes P-chlorophenols Aryl ketones Benzoyl derivatives O-bromophenols Bromobenzenes Chlorobenzenes Aryl bromides Aryl chlorides Acryloyl compounds Vinylogous acids Enones Organobromides Organochlorides Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
2'-hydroxychalcone - Cinnamylphenol - Cinnamic acid or derivatives - Trifluoromethylbenzene - Benzoyl - 4-halophenol - 2-halophenol - 2-bromophenol - Aryl ketone - 4-chlorophenol - Styrene - Bromobenzene - Chlorobenzene - Halobenzene - Phenol - Benzenoid - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Alpha,beta-unsaturated ketone - Acryloyl-group - Enone - Vinylogous acid - Ketone - Organic oxide - Alkyl fluoride - Organochloride - Organic oxygen compound - Organohalogen compound - Organobromide - Organooxygen compound - Alkyl halide - Hydrocarbon derivative - Organofluoride - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2'-hydroxychalcones. These are organic compounds containing chalcone skeleton that carries a hydroxyl group at the 2'-position.
External Descriptors
Not available