3-[(2-Bromophenyl)sulfanyl]-1,1,1-trifluoro-2-propanol CAS 958452-13-6

Purity 97%+In StockPharmaceutical Standards
CAS No.958452-13-6
Molecular FormulaC9H8BrF3OS
Molecular Weight301.12 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-[(2-Bromophenyl)sulfanyl]-1,1,1-trifluoro-2-propanol CAS 958452-13-6 chemical structure

Description

The occurrence of 3-[(2-Bromophenyl)sulfanyl]-1,1,1-trifluoro-2-propanol is closely related to sulfur-containing functionality, a hydroxyl group, an ether linkage, fluorine/bromine substitution, an aromatic ring system in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

3-[(2-Bromophenyl)sulfanyl]-1,1,1-trifluoro-2-propanol (CAS 958452-13-6), molecular formula C9H8BrF3OS and molecular weight 301.12 g/mol, is a CATO reference standard with documented purity and traceability.

The molecular framework of 3-[(2-Bromophenyl)sulfanyl]-1,1,1-trifluoro-2-propanol (C9H8BrF3OS) is characterized by sulfur-containing functionality, a hydroxyl group, an ether linkage, fluorine/bromine substitution, an aromatic ring system. In reversed-phase chromatography, its retention is governed primarily by the polarity and ionization state of its functional groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. 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), 3-[(2-Bromophenyl)sulfanyl]-1,1,1-trifluoro-2-propanol 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 FormulaC9H8BrF3OS
Molecular Weight301.12 g/mol
Purity97%+
StorageStore at room temperature
Solubility (reference)Soluble in methanol, acetonitrile, DMSO, water (slightly soluble)
StabilityMay oxidize slowly on prolonged air exposure
Degree of Unsaturation (DBE)4.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Halogen ContentF/Br-containing
Sulfur Atoms1

Related Bromophenyl Standards

Recommended Standards

Why CATO?