Methyl 2-[(2-methylpropyl)sulfanyl]benzoate CAS 1794367-72-8

Description

The occurrence of Methyl 2-[(2-methylpropyl)sulfanyl]benzoate is closely related to a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage, an aromatic ring system in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

Methyl 2-[(2-methylpropyl)sulfanyl]benzoate (CAS 1794367-72-8), molecular formula C12H16O2S and molecular weight 224.32 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, Methyl 2-[(2-methylpropyl)sulfanyl]benzoate (C12H16O2S) contains a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage, an aromatic ring system. 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 224.32 g/mol, it falls into the medium-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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