Description

1-Bromo-3-(2-Hydroxy-3,3,3-Trifluoro-n-Propylthio)-Benzene is a high-value, multi-functional organosulfur and organofluorine building block designed for advanced synthetic chemistry. Its unique structure, featuring a bromoarene, a thioether linkage, and a trifluoropropanol moiety, makes it a critical intermediate for constructing complex molecules with tailored properties. This compound is essential for researchers and process chemists in the pharmaceutical and agrochemical industries, where it is used to introduce fluorinated thioether pharmacophores and to enable selective cross-coupling reactions.

Application

• Pharmaceutical Intermediate: Key building block for the synthesis of novel active pharmaceutical ingredients (APIs), particularly those targeting central nervous system (CNS) disorders and metabolic diseases.
• Agrochemical Synthesis: Used in the research and development of next-generation herbicides, fungicides, and insecticides, leveraging the bioactivity of the fluorine and sulfur-containing groups.
• Ligand and Catalyst Development: Serves as a precursor for creating specialized ligands in transition metal catalysis, such as palladium-catalyzed cross-coupling reactions (Suzuki, Buchwald-Hartwig).
• Material Science Research: Employed in the synthesis of fluorinated polymers and advanced organic electronic materials to modify solubility and electronic properties.
• Custom Chemical Synthesis: A versatile starting material for contract research organizations (CROs) and CDMOs producing bespoke compounds for client projects.

Basic Information

Product Name	1-Bromo-3-(2-Hydroxy-3,3,3-Trifluoro-n-Propylthio)-Benzene
CAS No.	958452-05-6
Molecular Formula	C9H8BrF3OS
Molecular Weight	301.12 g/mol
Synonyms	3-[(2-Hydroxy-3,3,3-trifluoropropyl)sulfanyl]bromobenzene; 1-Bromo-3-[(2-hydroxy-3,3,3-trifluoropropyl)thio]benzene; 3-Bromophenyl 2-hydroxy-3,3,3-trifluoropropyl sulfide; 958452-05-6; 3-Bromophenyl 3,3,3-trifluoro-2-hydroxypropyl sulfide
EINECS	Contact for details

Quality Control

Our 1-Bromo-3-(2-Hydroxy-3,3,3-Trifluoro-n-Propylthio)-Benzene is manufactured under strict quality management systems. Every batch undergoes rigorous analytical testing, including HPLC, GC, NMR, and mass spectrometry, to ensure identity, purity, and consistency. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing all specified parameters. Our quality commitment aligns with cGMP principles for advanced intermediates, ensuring reliability for your critical R&D and scale-up processes.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (15-25°C). Keep the container tightly sealed to prevent moisture absorption and ensure chemical integrity over the long term.

Specification

Item	Specification
Appearance	Colorless to pale yellow liquid or low-melting solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0% (Area %)
Water Content (KF)	≤ 0.5%

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.