Octahydrothianthrene-4a,9a(2H,5aH)-diol CAS 68134-79-2

Purity 97%+In StockPharmaceutical Standards
CAS No.68134-79-2
Molecular FormulaC12H20O2S2
Molecular Weight260.42 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Octahydrothianthrene-4a,9a(2H,5aH)-diol CAS 68134-79-2 chemical structure

Description

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.

Octahydrothianthrene-4a,9a(2H,5aH)-diol (CAS 68134-79-2) is a high-purity analytical reference standard with the molecular formula C12H20O2S2 and a molecular weight of 260.42 g/mol.

Structurally, Octahydrothianthrene-4a,9a(2H,5aH)-diol (C12H20O2S2) contains a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage. The molecule exhibits a degree of unsaturation (DBE) of 3.0, corresponding to approximately 3 ring(s) or double-bond equivalent(s). With a molecular weight of 260.42 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.

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 FormulaC12H20O2S2
Molecular Weight260.42 g/mol
Purity97%+
StorageStore at room temperature
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure
Degree of Unsaturation (DBE)3.0
UV AbsorptionUV-absorbing
CAS Registry Year (est.)1976
Sulfur Atoms2

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