3-(4-Bromophenyl)-3-oxo-N,N,N-tripropylprop-1-en-1-aminium chloride CAS 252367-64-9

Purity 97%+In StockPharmaceutical Standards
CAS No.252367-64-9
Molecular FormulaC18H27BrNO
Molecular WeightN/A
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-(4-Bromophenyl)-3-oxo-N,N,N-tripropylprop-1-en-1-aminium chloride CAS 252367-64-9 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 388.77 g/mol gives 3-(4-Bromophenyl)-3-oxo-N,N,N-tripropylprop-1-en-1-aminium chloride distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

CATO supplies 3-(4-Bromophenyl)-3-oxo-N,N,N-tripropylprop-1-en-1-aminium chloride (CAS 252367-64-9), a certified reference material (molecular formula C18H27BrNOCl, MW 388.77 g/mol) for analytical method development and quality control.

Structurally, 3-(4-Bromophenyl)-3-oxo-N,N,N-tripropylprop-1-en-1-aminium chloride (C18H27BrNOCl) contains a steroid core, an amide group, a hydroxyl group, an ether linkage, chlorine/bromine substitution. The molecule exhibits a degree of unsaturation (DBE) of 5.0, corresponding to approximately 5 ring(s) or double-bond equivalent(s). With a molecular weight of 388.77 g/mol, it falls into the moderately-high-molecular-weight range. 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 FormulaC18H27BrNO Cl
Molecular Weight388.77 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentCl/Br-containing
Nitrogen Atoms1

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