methyl 2-[(4-bromobenzene)sulfinyl]acetate CAS 63216-00-2

Purity 97%+In StockPharmaceutical Standards
CAS No.63216-00-2
Molecular FormulaC9H9BrO3S
Molecular Weight277.13 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

methyl 2-[(4-bromobenzene)sulfinyl]acetate CAS 63216-00-2 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 277.13 g/mol gives methyl 2-[(4-bromobenzene)sulfinyl]acetate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

methyl 2-[(4-bromobenzene)sulfinyl]acetate (CAS 63216-00-2) is a high-purity analytical reference standard with the molecular formula C9H9BrO3S and a molecular weight of 277.13 g/mol.

methyl 2-[(4-bromobenzene)sulfinyl]acetate (C9H9BrO3S) contains a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage, bromine substitution, an aromatic ring system. It is notably hygroscopic, halogen substitution raises its density and boiling point, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

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 FormulaC9H9BrO3S
Molecular Weight277.13 g/mol
Purity97%+
StorageStore in a cool place (≤25°C), keep sealed and dry, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, ethanol, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1975
Halogen ContentBr-containing
Sulfur Atoms1

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