3-Bromo-5-fluoro-N,N-diethylaniline CAS 1809161-70-3

Purity 97%+In StockPharmaceutical Standards
CAS No.1809161-70-3
Molecular FormulaC10H13BrFN
Molecular Weight246.12 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-Bromo-5-fluoro-N,N-diethylaniline CAS 1809161-70-3 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 246.12 g/mol gives 3-Bromo-5-fluoro-N,N-diethylaniline distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

3-Bromo-5-fluoro-N,N-diethylaniline (CAS 1809161-70-3) is a high-purity analytical reference standard with the molecular formula C10H13BrFN and a molecular weight of 246.12 g/mol.

Owing to a nitrogen-containing heterocyclic scaffold, a nitrile group, fluorine/bromine substitution, 3-Bromo-5-fluoro-N,N-diethylaniline is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 246.12 g/mol — guide the selection of appropriate sample preparation and analytical techniques. 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 FormulaC10H13BrFN
Molecular Weight246.12 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, faint amine-like odor, low volatility)
Purity97%+
StorageStore at 2-8°C, protect from light, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)4.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1995
Halogen ContentF/Br-containing
Nitrogen Atoms1

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