1-(4-Bromophenyl)-6-chlorohexan-1-one CAS 898767-00-5

Purity 97%+In StockPharmaceutical Standards
CAS No.898767-00-5
Molecular FormulaC12H14BrClO
Molecular Weight289.60 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-(4-Bromophenyl)-6-chlorohexan-1-one CAS 898767-00-5 chemical structure

Description

The occurrence of 1-(4-Bromophenyl)-6-chlorohexan-1-one is closely related to a hydroxyl group, an ether linkage, chlorine/bromine substitution, an aromatic ring system in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

1-(4-Bromophenyl)-6-chlorohexan-1-one (CAS 898767-00-5) is a high-purity analytical reference standard with the molecular formula C12H14BrClO and a molecular weight of 289.60 g/mol.

Based on its molecular formula C12H14BrClO, 1-(4-Bromophenyl)-6-chlorohexan-1-one contains a hydroxyl group, an ether linkage, chlorine/bromine substitution, an aromatic ring system; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 289.60 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).

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 FormulaC12H14BrClO
Molecular Weight289.60 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at room temperature, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Halogen ContentCl/Br-containing

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