Compound Identification
SMILES
COC(=O)C1=C(C)C(Cl)=C(O)C(C=O)=C1O
InChIKey
InChIKey=FFAOPIYWYBVPCE-UHFFFAOYSA-N
Formula
C10H9ClO5
Mass
244.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
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Level 5
Benzoic acid esters
- Level 6 p-Hydroxybenzoic acid esters
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Level 5
Benzoic acid esters
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Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Benzoic acid esters - p-Hydroxybenzoic acid esters
Direct Parent
p-Hydroxybenzoic acid alkyl esters
Alternative Parents
o-Hydroxybenzoic acid esters 3-halobenzoic acids and derivatives Salicylic acid and derivatives Hydroxybenzaldehydes Benzoyl derivatives Meta cresols O-chlorophenols P-chlorophenols Resorcinols Toluenes Chlorobenzenes Aryl chlorides Methyl esters Vinylogous acids Monocarboxylic acids and derivatives Organic oxides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
P-hydroxybenzoic acid alkyl ester - O-hydroxybenzoic acid ester - Dihydroxybenzoic acid - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Salicylic acid or derivatives - Hydroxybenzaldehyde - Benzaldehyde - Benzoyl - 4-halophenol - 2-halophenol - M-cresol - 2-chlorophenol - Resorcinol - 4-chlorophenol - Chlorobenzene - Halobenzene - Aryl-aldehyde - Toluene - Phenol - Aryl chloride - Aryl halide - Methyl ester - Vinylogous acid - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Aldehyde - Organic oxide - Organohalogen compound - Organochloride - Organooxygen compound - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as p-hydroxybenzoic acid alkyl esters. These are aromatic compounds containing a benzoic acid, which is esterified with an alkyl group and para-substituted with a hydroxyl group.
External Descriptors
Not available