2-(3-Benzylthioureido)benzoic acid CAS 400755-34-2

Purity 97%+In StockPharmaceutical Standards
CAS No.400755-34-2
Molecular FormulaC15H14N2O2S
Molecular Weight286.35 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-(3-Benzylthioureido)benzoic acid CAS 400755-34-2 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 286.35 g/mol gives 2-(3-Benzylthioureido)benzoic acid distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

CATO supplies 2-(3-Benzylthioureido)benzoic acid (CAS 400755-34-2), a certified reference material (molecular formula C15H14N2O2S, MW 286.35 g/mol) for analytical method development and quality control.

2-(3-Benzylthioureido)benzoic acid (C15H14N2O2S) contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage. It is notably hygroscopic, its high carbon-to-hydrogen ratio confers good lipid solubility, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

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 FormulaC15H14N2O2S
Molecular Weight286.35 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening
Degree of Unsaturation (DBE)10.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Nitrogen Atoms2
Sulfur Atoms1

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