6-Chloro-1-((3-(diethylamino)propyl)(methyl)amino)-4-methyl-9H-thioxanthen-9-one CAS 3546-16-5

Description

Compared with other compounds in its class, the molecular weight of 402.98 g/mol gives 6-Chloro-1-((3-(diethylamino)propyl)(methyl)amino)-4-methyl-9H-thioxanthen-9-one distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

6-Chloro-1-((3-(diethylamino)propyl)(methyl)amino)-4-methyl-9H-thioxanthen-9-one (CAS 3546-16-5), molecular formula C22H27ClN2OS and molecular weight 402.98 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 6-Chloro-1-((3-(diethylamino)propyl)(methyl)amino)-4-methyl-9H-thioxanthen-9-one (C22H27ClN2OS) contains a steroid core, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 10.0, corresponding to approximately 10 ring(s) or double-bond equivalent(s). With a molecular weight of 402.98 g/mol, it falls into the moderately-high-molecular-weight range. 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.

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

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