8-(Cyclopent-3-en-1-yl)-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione CAS 478081-33-3

Purity 97%+In StockPharmaceutical Standards
CAS No.478081-33-3
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

8-(Cyclopent-3-en-1-yl)-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione CAS 478081-33-3 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 246.27 g/mol gives 8-(Cyclopent-3-en-1-yl)-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

CATO supplies 8-(Cyclopent-3-en-1-yl)-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione (CAS 478081-33-3), a certified reference material (molecular formula C12H14N4O2, MW 246.27 g/mol) for analytical method development and quality control.

Based on its molecular formula C12H14N4O2, 8-(Cyclopent-3-en-1-yl)-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione contains an amino-acid-derived structure, an amide group, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 246.27 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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 FormulaC12H14N4O2
Molecular Weight246.27 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)8.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Nitrogen Atoms4

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