2-(3-Bromophenyl)-2-(piperazin-1-yl)acetonitrile CAS 1000406-42-7

Purity 97%+In StockPharmaceutical Standards
CAS No.1000406-42-7
Molecular FormulaC12H14BrN3
Molecular Weight280.16 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-(3-Bromophenyl)-2-(piperazin-1-yl)acetonitrile CAS 1000406-42-7 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 280.16 g/mol gives 2-(3-Bromophenyl)-2-(piperazin-1-yl)acetonitrile distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

CATO supplies 2-(3-Bromophenyl)-2-(piperazin-1-yl)acetonitrile (CAS 1000406-42-7), a certified reference material (molecular formula C12H14BrN3, MW 280.16 g/mol) for analytical method development and quality control.

Based on its molecular formula C12H14BrN3, 2-(3-Bromophenyl)-2-(piperazin-1-yl)acetonitrile contains a nitrogen-containing heterocyclic scaffold, a nitrile group, bromine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 280.16 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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 FormulaC12H14BrN3
Molecular Weight280.16 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-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)7.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1988
Halogen ContentBr-containing
Nitrogen Atoms3

Related Bromophenyl Standards

Recommended Standards

Why CATO?