3-[1-(2-carbamoylethyl)-3-(4-chlorophenyl)-1h-pyrazol-4-yl]-2-cyanoprop-2-enoic acid CAS 1006493-20-4

Purity 97%+In StockPharmaceutical Standards
CAS No.1006493-20-4
Molecular FormulaC16H13ClN4O3
Molecular Weight344.75 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-[1-(2-carbamoylethyl)-3-(4-chlorophenyl)-1h-pyrazol-4-yl]-2-cyanoprop-2-enoic acid CAS 1006493-20-4 chemical structure

Description

3-[1-(2-carbamoylethyl)-3-(4-chlorophenyl)-1h-pyrazol-4-yl]-2-cyanoprop-2-enoic acid (CAS 1006493-20-4), molecular formula C16H13ClN4O3 and molecular weight 344.75 g/mol, is a CATO reference standard with documented purity and traceability.

The molecular framework of 3-[1-(2-carbamoylethyl)-3-(4-chlorophenyl)-1h-pyrazol-4-yl]-2-cyanoprop-2-enoic acid (C16H13ClN4O3) is characterized by a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. 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.

CATO manufactures 3-[1-(2-carbamoylethyl)-3-(4-chlorophenyl)-1h-pyrazol-4-yl]-2-cyanoprop-2-enoic acid under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.

Physical & Chemical Properties

Molecular FormulaC16H13ClN4O3
Molecular Weight344.75 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
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)12.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1988
Halogen ContentCl-containing
Nitrogen Atoms4

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