6-(((4-Chlorophenyl)thio)methyl)-2-(pyridin-4-yl)pyrimidin-4(3H)-one CAS 860609-53-6

Purity 97%+In StockPharmaceutical Standards
CAS No.860609-53-6
Molecular FormulaC16H12ClN3OS
Molecular Weight329.80 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

6-(((4-Chlorophenyl)thio)methyl)-2-(pyridin-4-yl)pyrimidin-4(3H)-one CAS 860609-53-6 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-(((4-Chlorophenyl)thio)methyl)-2-(pyridin-4-yl)pyrimidin-4(3H)-one (CAS 860609-53-6), molecular formula C16H12ClN3OS and molecular weight 329.80 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 6-(((4-Chlorophenyl)thio)methyl)-2-(pyridin-4-yl)pyrimidin-4(3H)-one (C16H12ClN3OS) contains a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 12.0, corresponding to approximately 12 ring(s) or double-bond equivalent(s). With a molecular weight of 329.80 g/mol, it falls into the moderately-high-molecular-weight range. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

As a certified reference material (CRM), 6-(((4-Chlorophenyl)thio)methyl)-2-(pyridin-4-yl)pyrimidin-4(3H)-one meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.

Physical & Chemical Properties

Molecular FormulaC16H12ClN3OS
Molecular Weight329.80 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)12.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Halogen ContentCl-containing
Nitrogen Atoms3
Sulfur Atoms1

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