Compound Identification
SMILES
COC(=O)C1=CC(I)=C(I)C(I)=C1O
InChIKey
InChIKey=LPDJLRYOEXAQQT-UHFFFAOYSA-N
Formula
C8H5I3O3
Mass
529.838
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
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Level 5
Benzoic acid esters
- Level 6 o-Hydroxybenzoic acid esters
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Level 5
Benzoic acid esters
-
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
Direct Parent
o-Hydroxybenzoic acid esters
Alternative Parents
Salicylic acid and derivatives 3-halobenzoic acids and derivatives 4-halobenzoic acids and derivatives P-iodophenols O-iodophenols M-iodophenols Benzoyl derivatives Iodobenzenes Aryl iodides Vinylogous acids Methyl esters Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organoiodides Organooxygen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
O-hydroxybenzoic acid ester - Salicylic acid or derivatives - 3-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoyl - 4-halophenol - 3-halophenol - 2-halophenol - 3-iodophenol - 2-iodophenol - 4-iodophenol - Phenol - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Methyl ester - Vinylogous acid - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organooxygen compound - Organohalogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organoiodide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-hydroxybenzoic acid esters. These are benzoic acid esters where the benzene ring is ortho-substituted with a hydroxy group.
External Descriptors
Not available