2-((2-Cyano-3-methylbutan-2-yl)amino)-2-oxoethyl 2-((2,6-dichlorophenyl)thio)acetate CAS 875285-01-1

Purity 97%+In StockPharmaceutical Standards
CAS No.875285-01-1
Molecular FormulaC16H18Cl2N2O3S
Molecular Weight389.30 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-((2-Cyano-3-methylbutan-2-yl)amino)-2-oxoethyl 2-((2,6-dichlorophenyl)thio)acetate CAS 875285-01-1 chemical structure

Description

The occurrence of 2-((2-Cyano-3-methylbutan-2-yl)amino)-2-oxoethyl 2-((2,6-dichlorophenyl)thio)acetate is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, chlorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

CATO supplies 2-((2-Cyano-3-methylbutan-2-yl)amino)-2-oxoethyl 2-((2,6-dichlorophenyl)thio)acetate (CAS 875285-01-1), a certified reference material (molecular formula C16H18Cl2N2O3S, MW 389.30 g/mol) for analytical method development and quality control.

Based on its molecular formula C16H18Cl2N2O3S, 2-((2-Cyano-3-methylbutan-2-yl)amino)-2-oxoethyl 2-((2,6-dichlorophenyl)thio)acetate contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, chlorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 389.30 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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 FormulaC16H18Cl2N2O3S
Molecular Weight389.30 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; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)8.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Halogen ContentCl-containing
Nitrogen Atoms2
Sulfur Atoms1

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