1-(4-Bromo-1H-pyrazol-3-yl)ethan-1-one CAS 1552739-60-2

Purity 97%+In StockPharmaceutical Standards
CAS No.1552739-60-2
Molecular FormulaC5H5BrN2O
Molecular Weight189.01 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-(4-Bromo-1H-pyrazol-3-yl)ethan-1-one CAS 1552739-60-2 chemical structure

Description

The occurrence of 1-(4-Bromo-1H-pyrazol-3-yl)ethan-1-one is closely related to an amide group, a hydroxyl group, an ether linkage, bromine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

1-(4-Bromo-1H-pyrazol-3-yl)ethan-1-one (CAS 1552739-60-2), molecular formula C5H5BrN2O and molecular weight 189.01 g/mol, is a CATO reference standard with documented purity and traceability.

The molecular framework of 1-(4-Bromo-1H-pyrazol-3-yl)ethan-1-one (C5H5BrN2O) is characterized by an amide group, a hydroxyl group, an ether linkage, bromine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. 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 FormulaC5H5BrN2O
Molecular Weight189.01 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, faint amine-like odor)
Purity97%+
StorageStore at 2-8°C, protect from light, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)4.0
UV AbsorptionUV-absorbing
CAS Registry Year (est.)1992
Halogen ContentBr-containing
Nitrogen Atoms2

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