Methyl 2-(4-benzyl-2-isopropylpiperazin-1-yl)-5-nitrobenzoate CAS 1242268-07-0

Purity 97%+In StockPharmaceutical Standards
CAS No.1242268-07-0
Molecular FormulaC22H27N3O4
Molecular Weight397.47 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Methyl 2-(4-benzyl-2-isopropylpiperazin-1-yl)-5-nitrobenzoate CAS 1242268-07-0 chemical structure

Description

The occurrence of Methyl 2-(4-benzyl-2-isopropylpiperazin-1-yl)-5-nitrobenzoate 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.

Methyl 2-(4-benzyl-2-isopropylpiperazin-1-yl)-5-nitrobenzoate (CAS 1242268-07-0), molecular formula C22H27N3O4 and molecular weight 397.47 g/mol, is a CATO reference standard with documented purity and traceability.

Owing to a flavonoid core, an amide group, a hydroxyl group, an ether linkage, Methyl 2-(4-benzyl-2-isopropylpiperazin-1-yl)-5-nitrobenzoate is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 397.47 g/mol — guide the selection of appropriate sample preparation and analytical techniques. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

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 FormulaC22H27N3O4
Molecular Weight397.47 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)11.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1990
Nitrogen Atoms3

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