4-Bromobenzoylacetonitrile (4-bromobenzoyl)acetonitrile 4'-bromobenzoylacetonitrile p-bromobenzoylacetonitrile 3-(4-Bromophenyl)-3-oxopropanenitrile 4-Bromo-A-oxo-benzenepropanenitrile 4592-94-3 CAS 4592-94-3

Purity 97%+In StockPharmaceutical Standards
CAS No.4592-94-3
Molecular FormulaC9H12BrNO
Molecular Weight230.10 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-Bromobenzoylacetonitrile (4-bromobenzoyl)acetonitrile 4'-bromobenzoylacetonitrile p-bromobenzoylacetonitrile 3-(4-Bromophenyl)-3-oxopropanenitrile 4-Bromo-A-oxo-benzenepropanenitrile 4592-94-3 CAS 4592-94-3 chemical structure

Description

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

4-Bromobenzoylacetonitrile (4-bromobenzoyl)acetonitrile 4'-bromobenzoylacetonitrile p-bromobenzoylacetonitrile 3-(4-Bromophenyl)-3-oxopropanenitrile 4-Bromo-A-oxo-benzenepropanenitrile 4592-94-3 (CAS 4592-94-3), molecular formula C9H12BrNO and molecular weight 230.10 g/mol, is a CATO reference standard with documented purity and traceability.

Based on its molecular formula C9H12BrNO, 4-Bromobenzoylacetonitrile (4-bromobenzoyl)acetonitrile 4'-bromobenzoylacetonitrile p-bromobenzoylacetonitrile 3-(4-Bromophenyl)-3-oxopropanenitrile 4-Bromo-A-oxo-benzenepropanenitrile 4592-94-3 contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, bromine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 230.10 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).

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 FormulaC9H12BrNO
Molecular Weight230.10 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, faint amine-like odor)
Purity97%+
StorageStore at 2-8°C, protect from light, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, acetonitrile, DMSO, water (slightly soluble)
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.)1958
Halogen ContentBr-containing
Nitrogen Atoms1

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