2,4,6-Tribromobenzothiazole CAS 412923-36-5

Purity 97%+In StockPharmaceutical Standards
CAS No.412923-36-5
Molecular FormulaC7H2Br3NS
Molecular Weight371.87 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2,4,6-Tribromobenzothiazole CAS 412923-36-5 chemical structure

Description

The occurrence of 2,4,6-Tribromobenzothiazole is closely related to a nitrile group, sulfur-containing functionality, bromine substitution, an aromatic ring system in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

2,4,6-Tribromobenzothiazole (CAS 412923-36-5), molecular formula C7H2Br3NS and molecular weight 371.87 g/mol, is a CATO reference standard with documented purity and traceability.

Owing to a nitrile group, sulfur-containing functionality, bromine substitution, an aromatic ring system, 2,4,6-Tribromobenzothiazole is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 371.87 g/mol — guide the selection of appropriate sample preparation and analytical techniques. 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 FormulaC7H2Br3NS
Molecular Weight371.87 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in methanol, acetonitrile, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)6.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentBr-containing
Nitrogen Atoms1
Sulfur Atoms1

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