2-(2-Cyano-4-(difluoromethoxy)-5-mercaptophenyl)acetic acid CAS 1807231-50-0

Purity 97%+In StockPharmaceutical Standards
CAS No.1807231-50-0
Molecular FormulaC10H7F2NO3S
Molecular Weight259.23 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-(2-Cyano-4-(difluoromethoxy)-5-mercaptophenyl)acetic acid CAS 1807231-50-0 chemical structure

Description

2-(2-Cyano-4-(difluoromethoxy)-5-mercaptophenyl)acetic acid (CAS 1807231-50-0) is a high-purity analytical reference standard with the molecular formula C10H7F2NO3S and a molecular weight of 259.23 g/mol.

Owing to a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution, 2-(2-Cyano-4-(difluoromethoxy)-5-mercaptophenyl)acetic acid is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 259.23 g/mol — guide the selection of appropriate sample preparation and analytical techniques. 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 FormulaC10H7F2NO3S
Molecular Weight259.23 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, ethanol, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)7.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1995
Halogen ContentF-containing
Nitrogen Atoms1
Sulfur Atoms1

Related Cyano Standards

Recommended Standards

Why CATO?