4-(4-Benzylpiperazin-1-yl)-2-bromobenzonitrile CAS 1713160-47-4

Purity 97%+In StockPharmaceutical Standards
CAS No.1713160-47-4
Molecular FormulaC18H18BrN3
Molecular Weight356.26 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-(4-Benzylpiperazin-1-yl)-2-bromobenzonitrile CAS 1713160-47-4 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 356.26 g/mol gives 4-(4-Benzylpiperazin-1-yl)-2-bromobenzonitrile distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

4-(4-Benzylpiperazin-1-yl)-2-bromobenzonitrile (CAS 1713160-47-4), molecular formula C18H18BrN3 and molecular weight 356.26 g/mol, is a CATO reference standard with documented purity and traceability.

Based on its molecular formula C18H18BrN3, 4-(4-Benzylpiperazin-1-yl)-2-bromobenzonitrile 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 356.26 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.

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

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 FormulaC18H18BrN3
Molecular Weight356.26 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor)
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)11.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1994
Halogen ContentBr-containing
Nitrogen Atoms3

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