Oxo Thiamine O-Diphosphate CAS 59733-97-0

Purity 97%+In StockPharmaceutical Standards
CAS No.59733-97-0
Molecular FormulaC12H18N4O8P2S
Molecular Weight440.31 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Oxo Thiamine O-Diphosphate CAS 59733-97-0 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 440.31 g/mol gives Oxo Thiamine O-Diphosphate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

Oxo Thiamine O-Diphosphate (CAS 59733-97-0) is a high-purity analytical reference standard with the molecular formula C12H18N4O8P2S and a molecular weight of 440.31 g/mol.

Based on its molecular formula C12H18N4O8P2S, Oxo Thiamine O-Diphosphate contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a phosphate ester group, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 440.31 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

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 FormulaC12H18N4O8P2S
Molecular Weight440.31 g/mol
Purity97%+
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
Degree of Unsaturation (DBE)6.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1974
Nitrogen Atoms4
Sulfur Atoms1

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