Ethyl 5-(4-chlorophenyl)-2H-pyrazole-3-carboxylate CAS 595610-40-5

Purity 97%+In StockPharmaceutical Standards
CAS No.595610-40-5
Molecular FormulaC12H11ClN2O2
Molecular Weight250.68 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Ethyl 5-(4-chlorophenyl)-2H-pyrazole-3-carboxylate CAS 595610-40-5 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 250.68 g/mol gives Ethyl 5-(4-chlorophenyl)-2H-pyrazole-3-carboxylate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

Ethyl 5-(4-chlorophenyl)-2H-pyrazole-3-carboxylate (CAS 595610-40-5), molecular formula C12H11ClN2O2 and molecular weight 250.68 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, Ethyl 5-(4-chlorophenyl)-2H-pyrazole-3-carboxylate (C12H11ClN2O2) 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 8.0, corresponding to approximately 8 ring(s) or double-bond equivalent(s). With a molecular weight of 250.68 g/mol, it falls into the medium-molecular-weight range. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

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 FormulaC12H11ClN2O2
Molecular Weight250.68 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor)
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)8.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1984
Halogen ContentCl-containing
Nitrogen Atoms2

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