5-Bromo-6,7-dihydrobenzo[b]thiophen-4(5h)-one CAS 2513-49-7

Purity 97%+In StockPharmaceutical Standards
CAS No.2513-49-7
Molecular FormulaC8H7BrOS
Molecular Weight231.11 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

5-Bromo-6,7-dihydrobenzo[b]thiophen-4(5h)-one CAS 2513-49-7 chemical structure

Description

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

CATO supplies 5-Bromo-6,7-dihydrobenzo[b]thiophen-4(5h)-one (CAS 2513-49-7), a certified reference material (molecular formula C8H7BrOS, MW 231.11 g/mol) for analytical method development and quality control.

Structurally, 5-Bromo-6,7-dihydrobenzo[b]thiophen-4(5h)-one (C8H7BrOS) contains sulfur-containing functionality, a hydroxyl group, an ether linkage, bromine substitution, 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 231.11 g/mol, it falls into the medium-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

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 FormulaC8H7BrOS
Molecular Weight231.11 g/mol
Purity97%+
StorageStore at room temperature, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, acetonitrile, DMSO, water (slightly soluble)
StabilityMay oxidize slowly on prolonged air exposure
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1957
Halogen ContentBr-containing
Sulfur Atoms1

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