1-(1,1-Dioxidotetrahydrothiophen-3-yl)-3-methylthiourea CAS 85109-46-2

Purity 97%+In StockPharmaceutical Standards
CAS No.85109-46-2
Molecular FormulaC6H12N2O2S2
Molecular Weight208.30 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-(1,1-Dioxidotetrahydrothiophen-3-yl)-3-methylthiourea CAS 85109-46-2 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 208.30 g/mol gives 1-(1,1-Dioxidotetrahydrothiophen-3-yl)-3-methylthiourea distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

1-(1,1-Dioxidotetrahydrothiophen-3-yl)-3-methylthiourea (CAS 85109-46-2) is a high-purity analytical reference standard with the molecular formula C6H12N2O2S2 and a molecular weight of 208.30 g/mol.

The molecular framework of 1-(1,1-Dioxidotetrahydrothiophen-3-yl)-3-methylthiourea (C6H12N2O2S2) is characterized by an amide group, a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

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 FormulaC6H12N2O2S2
Molecular Weight208.30 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityLight-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening
Degree of Unsaturation (DBE)2.0
CAS Registry Year (est.)1981
Nitrogen Atoms2
Sulfur Atoms2

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