5-(4-Bromophenyl)-1-(o-tolyl)-1h-imidazole-2-thiol CAS 1105190-06-4

Purity 97%+In StockPharmaceutical Standards
CAS No.1105190-06-4
Molecular FormulaC16H13BrN2S
Molecular Weight345.26 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

5-(4-Bromophenyl)-1-(o-tolyl)-1h-imidazole-2-thiol CAS 1105190-06-4 chemical structure

Description

The occurrence of 5-(4-Bromophenyl)-1-(o-tolyl)-1h-imidazole-2-thiol is closely related to a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, bromine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

5-(4-Bromophenyl)-1-(o-tolyl)-1h-imidazole-2-thiol (CAS 1105190-06-4), molecular formula C16H13BrN2S and molecular weight 345.26 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 5-(4-Bromophenyl)-1-(o-tolyl)-1h-imidazole-2-thiol (C16H13BrN2S) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, bromine substitution. The molecule exhibits a degree of unsaturation (DBE) of 11.0, corresponding to approximately 11 ring(s) or double-bond equivalent(s). With a molecular weight of 345.26 g/mol, it falls into the moderately-high-molecular-weight range. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).

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 FormulaC16H13BrN2S
Molecular Weight345.26 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)11.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1989
Halogen ContentBr-containing
Nitrogen Atoms2
Sulfur Atoms1

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