2-(2-Thiocyanatoethyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione CAS 102367-29-3

Purity 97%+In StockPharmaceutical Standards
CAS No.102367-29-3
Molecular FormulaC11H6N2O3S
Molecular Weight246.24 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-(2-Thiocyanatoethyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione CAS 102367-29-3 chemical structure

Description

2-(2-Thiocyanatoethyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione (CAS 102367-29-3), molecular formula C11H6N2O3S and molecular weight 246.24 g/mol, is a CATO reference standard with documented purity and traceability.

Based on its molecular formula C11H6N2O3S, 2-(2-Thiocyanatoethyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 246.24 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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 FormulaC11H6N2O3S
Molecular Weight246.24 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
Solubility (reference)Soluble in methanol, ethanol, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening
Degree of Unsaturation (DBE)10.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1986
Nitrogen Atoms2
Sulfur Atoms1

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