Celecoxib Impurity 3(Celecoxib Carboxylic Acid) CAS 170571-01-4

Purity >95%In StockPharmacopoeial Impurity Standards
CAS No.170571-01-4
Molecular FormulaC17H12F3N3O4S
Molecular Weight411.36 g/mol
CategoryPharmacopoeial Impurity Standards / EP Impurities
AvailabilityIn Stock

Chemical Structure

Celecoxib Impurity 3(Celecoxib Carboxylic Acid) CAS 170571-01-4 chemical structure

Description

CATO manufactures Celecoxib Impurity 3(Celecoxib Carboxylic Acid) under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.

Celecoxib Impurity 3(Celecoxib Carboxylic Acid) (CAS 170571-01-4) is a certified pharmaceutical impurity reference standard with the molecular formula C17H12F3N3O4S and a molecular weight of 411.36 g/mol.

Based on its molecular formula C17H12F3N3O4S, Celecoxib Impurity 3(Celecoxib Carboxylic Acid) contains a flavonoid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 411.36 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

Recommended for quantitative analysis by HPLC, GC, LC-MS/MS, or GC-MS as an external calibration standard; it can also be used for spiked-recovery experiments, LOD/LOQ determination, and LC-MS/MS multiple-reaction-monitoring (MRM) calibration.

Physical & Chemical Properties

Molecular FormulaC17H12F3N3O4S
Molecular Weight411.36 g/mol
Purity>95%
StorageStore in a cool place (≤25°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)12.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2005
Halogen ContentF-containing
Nitrogen Atoms3
Sulfur Atoms1

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