6-(Ethanesulfonyl)-4-(thiophene-2-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid CAS 866051-07-2

Purity 97%+In StockPharmaceutical Standards
CAS No.866051-07-2
Molecular FormulaC15H15NO7S3
Molecular Weight417.48 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

6-(Ethanesulfonyl)-4-(thiophene-2-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid CAS 866051-07-2 chemical structure

Description

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.

6-(Ethanesulfonyl)-4-(thiophene-2-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid (CAS 866051-07-2), molecular formula C15H15NO7S3 and molecular weight 417.48 g/mol, is a CATO reference standard with documented purity and traceability.

The molecular framework of 6-(Ethanesulfonyl)-4-(thiophene-2-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid (C15H15NO7S3) is characterized by a flavonoid core, 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.

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 FormulaC15H15NO7S3
Molecular Weight417.48 g/mol
Purity97%+
StorageStore at room temperature, protect from light, keep sealed and dry
Solubility (reference)Soluble in methanol, acetonitrile, DMSO, water (slightly soluble)
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)9.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Nitrogen Atoms1
Sulfur Atoms3

Related Ethanesulfonyl Standards

Recommended Standards

Why CATO?