3-benzyl-3,6-diazabicyclo[3.1.1]heptan-2-one CAS 869494-13-3

Purity 97%+In StockPharmaceutical Standards
CAS No.869494-13-3
Molecular FormulaC12H14N2O
Molecular Weight202.25 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-benzyl-3,6-diazabicyclo[3.1.1]heptan-2-one CAS 869494-13-3 chemical structure

Description

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.

CATO supplies 3-benzyl-3,6-diazabicyclo[3.1.1]heptan-2-one (CAS 869494-13-3), a certified reference material (molecular formula C12H14N2O, MW 202.25 g/mol) for analytical method development and quality control.

Owing to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, 3-benzyl-3,6-diazabicyclo[3.1.1]heptan-2-one is typically off-white to pale yellow low-melting solid. Its solid-state physicochemical attributes — including a molecular weight of 202.25 g/mol — guide the selection of appropriate sample preparation and analytical techniques. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

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.

Physical & Chemical Properties

Molecular FormulaC12H14N2O
Molecular Weight202.25 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityLight-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)7.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Nitrogen Atoms2

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