3-(3,4-Dimethylphenoxy)-7-hydroxy-8-((4-methylpiperidin-1-yl)methyl)-2-(trifluoromethyl)-4H-chromen-4-one CAS 685861-30-7

Purity 97%+In StockPharmaceutical Standards
CAS No.685861-30-7
Molecular FormulaC25H26F3NO4
Molecular Weight461.47 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-(3,4-Dimethylphenoxy)-7-hydroxy-8-((4-methylpiperidin-1-yl)methyl)-2-(trifluoromethyl)-4H-chromen-4-one CAS 685861-30-7 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 461.47 g/mol gives 3-(3,4-Dimethylphenoxy)-7-hydroxy-8-((4-methylpiperidin-1-yl)methyl)-2-(trifluoromethyl)-4H-chromen-4-one distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

CATO supplies 3-(3,4-Dimethylphenoxy)-7-hydroxy-8-((4-methylpiperidin-1-yl)methyl)-2-(trifluoromethyl)-4H-chromen-4-one (CAS 685861-30-7), a certified reference material (molecular formula C25H26F3NO4, MW 461.47 g/mol) for analytical method development and quality control.

Structurally, 3-(3,4-Dimethylphenoxy)-7-hydroxy-8-((4-methylpiperidin-1-yl)methyl)-2-(trifluoromethyl)-4H-chromen-4-one (C25H26F3NO4) contains a flavonoid core, an amide group, a hydroxyl group, an ether linkage, fluorine 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 461.47 g/mol, it falls into the moderately-high-molecular-weight range. 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.

As a certified reference material (CRM), 3-(3,4-Dimethylphenoxy)-7-hydroxy-8-((4-methylpiperidin-1-yl)methyl)-2-(trifluoromethyl)-4H-chromen-4-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 FormulaC25H26F3NO4
Molecular Weight461.47 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor, low volatility)
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; 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.)1985
Halogen ContentF-containing
Nitrogen Atoms1

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