methyl 5-bromo-4-fluoro-1H-pyrrole-3-carboxylate CAS 2092695-82-2

Purity 97%+In StockPharmaceutical Standards
CAS No.2092695-82-2
Molecular FormulaC6H9BrFNO2
Molecular Weight226.04 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

methyl 5-bromo-4-fluoro-1H-pyrrole-3-carboxylate CAS 2092695-82-2 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 226.04 g/mol gives methyl 5-bromo-4-fluoro-1H-pyrrole-3-carboxylate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

methyl 5-bromo-4-fluoro-1H-pyrrole-3-carboxylate (CAS 2092695-82-2) is a high-purity analytical reference standard with the molecular formula C6H9BrFNO2 and a molecular weight of 226.04 g/mol.

Owing to an amide group, a carboxylic acid group, a hydroxyl group, an ether linkage, fluorine/bromine substitution, methyl 5-bromo-4-fluoro-1H-pyrrole-3-carboxylate is typically white to off-white crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 226.04 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 FormulaC6H9BrFNO2
Molecular Weight226.04 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, acetonitrile, DMSO, water (slightly soluble)
StabilityLight-sensitive; avoid direct strong light; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)2.0
CAS Registry Year (est.)1997
Halogen ContentF/Br-containing
Nitrogen Atoms1

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