2-(4-(1H-imidazol-1-yl)phenyl)-2-((4-bromo-3-methylphenyl)amino)acetonitrile CAS 866157-65-5

Purity 97%+In StockPharmaceutical Standards
CAS No.866157-65-5
Molecular FormulaC18H15BrN4
Molecular Weight367.24 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-(4-(1H-imidazol-1-yl)phenyl)-2-((4-bromo-3-methylphenyl)amino)acetonitrile CAS 866157-65-5 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 367.24 g/mol gives 2-(4-(1H-imidazol-1-yl)phenyl)-2-((4-bromo-3-methylphenyl)amino)acetonitrile distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

2-(4-(1H-imidazol-1-yl)phenyl)-2-((4-bromo-3-methylphenyl)amino)acetonitrile (CAS 866157-65-5), molecular formula C18H15BrN4 and molecular weight 367.24 g/mol, is a CATO reference standard with documented purity and traceability.

The molecular framework of 2-(4-(1H-imidazol-1-yl)phenyl)-2-((4-bromo-3-methylphenyl)amino)acetonitrile (C18H15BrN4) is characterized by a nitrogen-containing heterocyclic scaffold, a nitrile group, bromine substitution. In reversed-phase chromatography, its retention is governed primarily by its high hydrophobicity (logP), which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

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 FormulaC18H15BrN4
Molecular Weight367.24 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)13.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Halogen ContentBr-containing
Nitrogen Atoms4

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