2,3-Dichloro-N-(4-cyano-3-methylisoxazol-5-yl)benzamide CAS 478043-91-3

Purity 97%+In StockPharmaceutical Standards
CAS No.478043-91-3
Molecular FormulaC12H7Cl2N3O2
Molecular Weight296.11 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2,3-Dichloro-N-(4-cyano-3-methylisoxazol-5-yl)benzamide CAS 478043-91-3 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 296.11 g/mol gives 2,3-Dichloro-N-(4-cyano-3-methylisoxazol-5-yl)benzamide distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

2,3-Dichloro-N-(4-cyano-3-methylisoxazol-5-yl)benzamide (CAS 478043-91-3) is a high-purity analytical reference standard with the molecular formula C12H7Cl2N3O2 and a molecular weight of 296.11 g/mol.

Structurally, 2,3-Dichloro-N-(4-cyano-3-methylisoxazol-5-yl)benzamide (C12H7Cl2N3O2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 10.0, corresponding to approximately 10 ring(s) or double-bond equivalent(s). With a molecular weight of 296.11 g/mol, it falls into the medium-molecular-weight range. 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 FormulaC12H7Cl2N3O2
Molecular Weight296.11 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry, 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; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)10.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentCl-containing
Nitrogen Atoms3

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