3-(((3-Methylthiophen-2-yl)methyl)amino)benzoic acid CAS 869950-52-7

Purity 97%+In StockPharmaceutical Standards
CAS No.869950-52-7
Molecular FormulaC13H13NO2S
Molecular Weight247.31 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-(((3-Methylthiophen-2-yl)methyl)amino)benzoic acid CAS 869950-52-7 chemical structure

Description

The occurrence of 3-(((3-Methylthiophen-2-yl)methyl)amino)benzoic acid is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

CATO supplies 3-(((3-Methylthiophen-2-yl)methyl)amino)benzoic acid (CAS 869950-52-7), a certified reference material (molecular formula C13H13NO2S, MW 247.31 g/mol) for analytical method development and quality control.

Based on its molecular formula C13H13NO2S, 3-(((3-Methylthiophen-2-yl)methyl)amino)benzoic acid contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 247.31 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC13H13NO2S
Molecular Weight247.31 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)8.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Nitrogen Atoms1
Sulfur Atoms1

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