2,2-Diacetyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarbonitrile CAS 478041-12-2

Purity 97%+In StockPharmaceutical Standards
CAS No.478041-12-2
Molecular FormulaC15H11N3O4
Molecular Weight297.27 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2,2-Diacetyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarbonitrile CAS 478041-12-2 chemical structure

Description

The occurrence of 2,2-Diacetyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarbonitrile is closely related to a flavonoid core, an amide group, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

CATO supplies 2,2-Diacetyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarbonitrile (CAS 478041-12-2), a certified reference material (molecular formula C15H11N3O4, MW 297.27 g/mol) for analytical method development and quality control.

Based on its molecular formula C15H11N3O4, 2,2-Diacetyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarbonitrile contains a flavonoid core, an amide group, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 297.27 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 FormulaC15H11N3O4
Molecular Weight297.27 g/mol
AppearancePale yellow to yellow crystalline powder
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
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
Degree of Unsaturation (DBE)12.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Nitrogen Atoms3

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