Compound Identification
SMILES
COC1=CC=CC=C1C(=O)CCC(CC(=O)C1=CC=C(C=C1)C1=CC=C(Cl)C=C1)C(O)=O
InChIKey
InChIKey=FTSFKNZKQNHDKJ-UHFFFAOYSA-N
Formula
C26H23ClO5
Mass
450.92
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Biphenyls and derivatives
- Level 5 Chlorinated biphenyls
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Subclass
Biphenyls and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Chlorinated biphenyls
Alternative Parents
Alkyl-phenylketones Butyrophenones Medium-chain keto acids and derivatives Phenoxy compounds Anisoles Aryl alkyl ketones Methoxybenzenes Benzoyl derivatives Gamma-keto acids and derivatives Alkyl aryl ethers Branched fatty acids Halogenated fatty acids Chlorobenzenes Aryl chlorides Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Chlorinated biphenyl - Alkyl-phenylketone - Butyrophenone - Medium-chain keto acid - Phenylketone - Phenoxy compound - Gamma-keto acid - Anisole - Phenol ether - Aryl ketone - Benzoyl - Methoxybenzene - Aryl alkyl ketone - Chlorobenzene - Alkyl aryl ether - Branched fatty acid - Halogenated fatty acid - Halobenzene - Aryl chloride - Aryl halide - Fatty acyl - Keto acid - Ketone - Carboxylic acid - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organohalogen compound - Organochloride - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as chlorinated biphenyls. These are organic compounds containing at least one chlorine atom attached to either benzene ring of the biphenyl moiety.
External Descriptors
Not available