4,5-Dibromo-2-(4-fluorophenyl)pyridazin-3(2H)-one CAS 221031-01-2

Purity 97%+In StockPharmaceutical Standards
CAS No.221031-01-2
Molecular FormulaC10H5Br2FN2O
Molecular Weight347.97 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4,5-Dibromo-2-(4-fluorophenyl)pyridazin-3(2H)-one CAS 221031-01-2 chemical structure

Description

4,5-Dibromo-2-(4-fluorophenyl)pyridazin-3(2H)-one (CAS 221031-01-2) is a high-purity analytical reference standard with the molecular formula C10H5Br2FN2O and a molecular weight of 347.97 g/mol.

Structurally, 4,5-Dibromo-2-(4-fluorophenyl)pyridazin-3(2H)-one (C10H5Br2FN2O) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/bromine substitution. The molecule exhibits a degree of unsaturation (DBE) of 8.0, corresponding to approximately 8 ring(s) or double-bond equivalent(s). With a molecular weight of 347.97 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.

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 FormulaC10H5Br2FN2O
Molecular Weight347.97 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor, faint amine-like odor, low volatility)
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)8.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2020
Halogen ContentF/Br-containing
Nitrogen Atoms2

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