Compound Identification
SMILES
COC(=O)C1=C(C(=O)OC)C(OS(=O)(=O)C(F)(F)F)=C(Cl)C(=C1)C1=CC=C(C=C1)C(F)(F)F
InChIKey
InChIKey=DPPJQJFHHZNLEI-UHFFFAOYSA-N
Formula
C18H11ClF6O7S
Mass
520.78
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
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
3-halobenzoic acids and derivatives Trifluoromethylbenzenes 4-halobenzoic acids and derivatives Benzoic acid esters Trifluoromethanesulfonates Benzoyl derivatives Phenoxy compounds Chlorobenzenes Aryl chlorides Organosulfonic acid esters Sulfonic acid esters Methyl esters Methanesulfonates Sulfonyls Trihalomethanes Organooxygen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Chlorinated biphenyl - 3-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Trifluoromethylbenzene - Halobenzoic acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Trifluoromethanesulfonate - Phenoxy compound - Chlorobenzene - Halobenzene - Aryl halide - Aryl chloride - Organosulfonic acid ester - Sulfonic acid ester - Methyl ester - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methanesulfonate - Trihalomethane - Carboxylic acid ester - Carboxylic acid derivative - Organofluoride - Organooxygen compound - Organosulfur compound - Alkyl halide - Hydrocarbon derivative - Halomethane - Alkyl fluoride - Organic oxide - Organic oxygen compound - Organochloride - Organohalogen 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