3-(4-Chloro-1H-pyrazolo[3,4-d]pyrimidin-1-yl)benzonitrile CAS 1155075-44-7

Purity 97%+In StockPharmaceutical Standards
CAS No.1155075-44-7
Molecular FormulaC12H6ClN5
Molecular Weight255.66 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-(4-Chloro-1H-pyrazolo[3,4-d]pyrimidin-1-yl)benzonitrile CAS 1155075-44-7 chemical structure

Description

The molecular framework of 3-(4-Chloro-1H-pyrazolo[3,4-d]pyrimidin-1-yl)benzonitrile (C12H6ClN5) is characterized by a nitrogen-containing heterocyclic scaffold, a nitrile group, 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 aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

CATO supplies 3-(4-Chloro-1H-pyrazolo[3,4-d]pyrimidin-1-yl)benzonitrile (CAS 1155075-44-7), a certified reference material (molecular formula C12H6ClN5, MW 255.66 g/mol) for analytical method development and quality control.

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 FormulaC12H6ClN5
Molecular Weight255.66 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, 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
Degree of Unsaturation (DBE)12.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1989
Halogen ContentCl-containing
Nitrogen Atoms5

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