5-Fluoro-4-(trifluoromethyl)-2-((trimethylsilyl)ethynyl)aniline CAS 875306-77-7

Description

The occurrence of 5-Fluoro-4-(trifluoromethyl)-2-((trimethylsilyl)ethynyl)aniline is closely related to a nitrogen-containing heterocyclic scaffold, a nitrile group, fluorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

5-Fluoro-4-(trifluoromethyl)-2-((trimethylsilyl)ethynyl)aniline (CAS 875306-77-7), molecular formula C12H13F4NSi and molecular weight 275.32 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 5-Fluoro-4-(trifluoromethyl)-2-((trimethylsilyl)ethynyl)aniline (C12H13F4NSi) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, fluorine substitution. 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 275.32 g/mol, it falls into the medium-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

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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