2-[1-(1-methylcyclopropyl)sulfonylazetidin-3-ylidene]acetonitrile CAS 1187594-27-9

Purity 97%+In StockPharmaceutical Standards
CAS No.1187594-27-9
Molecular FormulaC9H12N2O2S
Molecular Weight212.27 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-[1-(1-methylcyclopropyl)sulfonylazetidin-3-ylidene]acetonitrile CAS 1187594-27-9 chemical structure

Description

The occurrence of 2-[1-(1-methylcyclopropyl)sulfonylazetidin-3-ylidene]acetonitrile is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

CATO supplies 2-[1-(1-methylcyclopropyl)sulfonylazetidin-3-ylidene]acetonitrile (CAS 1187594-27-9), a certified reference material (molecular formula C9H12N2O2S, MW 212.27 g/mol) for analytical method development and quality control.

Structurally, 2-[1-(1-methylcyclopropyl)sulfonylazetidin-3-ylidene]acetonitrile (C9H12N2O2S) contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage. The molecule exhibits a degree of unsaturation (DBE) of 5.0, corresponding to approximately 5 ring(s) or double-bond equivalent(s). With a molecular weight of 212.27 g/mol, it falls into the medium-molecular-weight range. 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.

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 FormulaC9H12N2O2S
Molecular Weight212.27 g/mol
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)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1989
Nitrogen Atoms2
Sulfur Atoms1

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