[5-Bromo-6-oxo-4-(4-phenylpiperazin-1-yl)-1,6-dihydropyridazin-1-yl]methyl acetate CAS 866039-36-3

Purity 97%+In StockPharmaceutical Standards
CAS No.866039-36-3
Molecular FormulaC17H19BrN4O3
Molecular Weight407.26 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

[5-Bromo-6-oxo-4-(4-phenylpiperazin-1-yl)-1,6-dihydropyridazin-1-yl]methyl acetate CAS 866039-36-3 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 407.26 g/mol gives [5-Bromo-6-oxo-4-(4-phenylpiperazin-1-yl)-1,6-dihydropyridazin-1-yl]methyl acetate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

[5-Bromo-6-oxo-4-(4-phenylpiperazin-1-yl)-1,6-dihydropyridazin-1-yl]methyl acetate (CAS 866039-36-3) is a high-purity analytical reference standard with the molecular formula C17H19BrN4O3 and a molecular weight of 407.26 g/mol.

Owing to a steroid core, an amide group, a hydroxyl group, an ether linkage, bromine substitution, [5-Bromo-6-oxo-4-(4-phenylpiperazin-1-yl)-1,6-dihydropyridazin-1-yl]methyl acetate is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 407.26 g/mol — guide the selection of appropriate sample preparation and analytical techniques. 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.

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 FormulaC17H19BrN4O3
Molecular Weight407.26 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor)
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; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)10.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Halogen ContentBr-containing
Nitrogen Atoms4

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