o-Toluic acid
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.
| Physical Appearance | Solid |
| Storage | -20°C |
| M.Wt | 136.15 |
| Cas No. | 118-90-1 |
| Formula | C8H8O2 |
| Solubility | insoluble in H2O; ≥31.6 mg/mL in DMSO; ≥38 mg/mL in EtOH |
| Chemical Name | 2-methylbenzoic acid |
| Canonical SMILES | CC1=C(C(O)=O)C=CC=C1 |
| Shipping Condition | Small 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. |







