6-Bromo-4,4-dimethylthiochroman 1-oxide CAS 864841-53-2

Purity 97%+In StockPharmaceutical Standards
CAS No.864841-53-2
Molecular FormulaC11H13BrOS
Molecular Weight273.19 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

6-Bromo-4,4-dimethylthiochroman 1-oxide CAS 864841-53-2 chemical structure

Description

The occurrence of 6-Bromo-4,4-dimethylthiochroman 1-oxide is closely related to sulfur-containing functionality, a hydroxyl group, an ether linkage, bromine substitution, an aromatic ring system in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

6-Bromo-4,4-dimethylthiochroman 1-oxide (CAS 864841-53-2) is a high-purity analytical reference standard with the molecular formula C11H13BrOS and a molecular weight of 273.19 g/mol.

Owing to sulfur-containing functionality, a hydroxyl group, an ether linkage, bromine substitution, an aromatic ring system, 6-Bromo-4,4-dimethylthiochroman 1-oxide is typically off-white to pale yellow low-melting solid. Its solid-state physicochemical attributes — including a molecular weight of 273.19 g/mol — guide the selection of appropriate sample preparation and analytical techniques. 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.

As a certified reference material (CRM), 6-Bromo-4,4-dimethylthiochroman 1-oxide meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.

Physical & Chemical Properties

Molecular FormulaC11H13BrOS
Molecular Weight273.19 g/mol
Purity97%+
StorageStore at room temperature, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Halogen ContentBr-containing
Sulfur Atoms1

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