Compound Identification
SMILES
CCOC(=O)C(CC(C)C)C1=C(C(OCC2CC2)=C(Cl)C(=C1)C1=CC=CC=C1)C(F)(F)F
InChIKey
InChIKey=KNUUUHYADAIAKC-UHFFFAOYSA-N
Formula
C25H28ClF3O3
Mass
468.94
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Biphenyls and derivatives
- Level 5 Chlorinated biphenyls
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Subclass
Biphenyls and derivatives
-
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
Trifluoromethylbenzenes Phenoxy compounds Phenol ethers Fatty acid esters Chlorobenzenes Alkyl aryl ethers Aryl chlorides Carboxylic acid esters Monocarboxylic acids and derivatives Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Chlorinated biphenyl - Trifluoromethylbenzene - Phenoxy compound - Phenol ether - Alkyl aryl ether - Chlorobenzene - Fatty acid ester - Halobenzene - Fatty acyl - Aryl chloride - Aryl halide - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Hydrocarbon derivative - Alkyl fluoride - Organic oxygen compound - Alkyl halide - Carbonyl group - Organohalogen compound - Organochloride - Organooxygen compound - Organic oxide - Organofluoride - 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