3-((5-Methylisoxazol-3-yl)amino)cyclohex-2-en-1-one CAS 1217863-06-3

Purity 97%+In StockPharmaceutical Standards
CAS No.1217863-06-3
Molecular FormulaC10H12N2O2
Molecular Weight192.21 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-((5-Methylisoxazol-3-yl)amino)cyclohex-2-en-1-one CAS 1217863-06-3 chemical structure

Description

3-((5-Methylisoxazol-3-yl)amino)cyclohex-2-en-1-one (CAS 1217863-06-3) is a high-purity analytical reference standard with the molecular formula C10H12N2O2 and a molecular weight of 192.21 g/mol.

Structurally, 3-((5-Methylisoxazol-3-yl)amino)cyclohex-2-en-1-one (C10H12N2O2) contains an amino-acid-derived structure, an amide group, a hydroxyl group, an ether linkage. The molecule exhibits a degree of unsaturation (DBE) of 6.0, corresponding to approximately 6 ring(s) or double-bond equivalent(s). With a molecular weight of 192.21 g/mol, it falls into the medium-molecular-weight range. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

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 FormulaC10H12N2O2
Molecular Weight192.21 g/mol
AppearanceOff-white to pale yellow crystalline powder. (faint amine-like odor)
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)6.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1990
Nitrogen Atoms2

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