N-(1,1-Dioxido-1,2-benzisothiazol-3-yl)alanine CAS 1396994-80-1

Purity 97%+In StockPharmaceutical Standards
CAS No.1396994-80-1
Molecular FormulaC10H10N2O4S
Molecular Weight254.26 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

N-(1,1-Dioxido-1,2-benzisothiazol-3-yl)alanine CAS 1396994-80-1 chemical structure

Description

The occurrence of N-(1,1-Dioxido-1,2-benzisothiazol-3-yl)alanine 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.

N-(1,1-Dioxido-1,2-benzisothiazol-3-yl)alanine (CAS 1396994-80-1) is a high-purity analytical reference standard with the molecular formula C10H10N2O4S and a molecular weight of 254.26 g/mol.

The molecular framework of N-(1,1-Dioxido-1,2-benzisothiazol-3-yl)alanine (C10H10N2O4S) is characterized by a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

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 FormulaC10H10N2O4S
Molecular Weight254.26 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
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
Degree of Unsaturation (DBE)7.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1991
Nitrogen Atoms2
Sulfur Atoms1

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