Compound Identification
SMILES
CC1=C(OC2CCCC2)C(O)=CC(F)=C1C(O)=O
InChIKey
InChIKey=XBHQWKKOIHTSRE-UHFFFAOYSA-N
Formula
C13H15FO4
Mass
254.257
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Hydroxybenzoic acid derivatives
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Subclass
Benzoic acids and derivatives
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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
Not available
Direct Parent
Hydroxybenzoic acid derivatives
Alternative Parents
2-halobenzoic acids Halobenzoic acids Benzoic acids Phenoxy compounds Phenol ethers 1-carboxy-2-haloaromatic compounds Meta cresols M-fluorophenols Benzoyl derivatives Toluenes 1-hydroxy-2-unsubstituted benzenoids Fluorobenzenes Alkyl aryl ethers Aryl fluorides Vinylogous halides Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Hydroxybenzoic acid - Halobenzoic acid - 2-halobenzoic acid - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Benzoic acid - Phenoxy compound - 3-halophenol - 3-fluorophenol - M-cresol - Benzoyl - 1-carboxy-2-haloaromatic compound - Phenol ether - Halobenzene - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Toluene - Fluorobenzene - Aryl halide - Aryl fluoride - Vinylogous halide - Carboxylic acid derivative - Carboxylic acid - Ether - Organic oxygen compound - Organofluoride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as hydroxybenzoic acid derivatives. These are compounds containing a hydroxybenzoic acid (or a derivative), which is a benzene ring bearing a carboxyl and a hydroxyl groups.
External Descriptors
Not available