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o-Toluic acid

Catalog No.
C6207
An exogenous metabolite and synthetic intermediate for research on drug metabolism mechanisms.
Grouped product items
SizePriceStock Qty
Evaluation Sample
$30.00
In stock
100g
$50.00
Ship with 5-10 days
For scientific research use only and should not be used for diagnostic or medical purposes.

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Background

o-Toluic acid (CAS No.: 118-90-1) is an aromatic carboxylic acid belonging to the class of benzoic acid derivatives and is widely recognized as a xenobiotic metabolite encountered in mammalian metabolic studies. As an exogenous small molecule, it is frequently utilized in biochemical and pharmacological research to investigate metabolic transformation pathways, substrate specificity, and enzyme-catalyzed oxidation or conjugation reactions, particularly within hepatic microsomal systems. Its structural characteristics make it a useful probe for studying phase I and phase II metabolism, including interactions with oxidoreductases and conjugating enzymes such as transferases, although no highly specific molecular targets have been definitively established. In vitro studies typically employ this compound at concentrations ranging from low micromolar to millimolar levels, depending on the experimental context, to evaluate metabolic stability, enzyme kinetics, and transport processes. Additionally, o-toluic acid serves as a versatile intermediate in the synthesis of more complex bioactive molecules, supporting medicinal chemistry efforts and pathway elucidation in drug discovery. It is commonly applied in cell-based assays and enzyme systems, as well as in preclinical models designed to characterize xenobiotic disposition, with dosing and concentration parameters adjusted according to specific experimental objectives.

Chemical Properties

Physical AppearanceSolid
Storage -20°C
M.Wt136.15
Cas No.118-90-1
FormulaC8H8O2
Solubilityinsoluble in H2O; ≥31.6 mg/mL in DMSO; ≥38 mg/mL in EtOH
Chemical Name2-methylbenzoic acid
Canonical SMILESCC1=C(C(O)=O)C=CC=C1
Shipping ConditionSmall Molecules with Blue Ice, Modified Nucleotides with Dry Ice.
General tips We do not recommend long-term storage for the solution, please use it up soon.

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