Description

3-(2-Bromo-Phenylsulfanyl)-1,1,1-Trifluoro-Propan-2-Ol is a specialized organosulfur and organofluorine building block of significant interest in advanced synthetic chemistry. Its molecular architecture, featuring a brominated phenylthioether group and a trifluoromethyl carbinol moiety, makes it a versatile intermediate for constructing complex molecules with tailored properties. This compound is primarily sought by pharmaceutical and agrochemical research & development teams for the synthesis of novel active ingredients, where the introduction of fluorine and sulfur can dramatically alter biological activity, metabolic stability, and lipophilicity.

Application

• Pharmaceutical Intermediate: Key building block in the synthesis of potential drug candidates, particularly those targeting central nervous system (CNS) disorders, inflammatory diseases, and oncology.
• Agrochemical Synthesis: Used in the research and development of new-generation herbicides, fungicides, and insecticides, where the trifluoromethyl group enhances bioactivity and environmental persistence.
• Material Science Precursor: Serves as a monomer or functionalization agent in the development of specialty polymers, liquid crystals, and organic electronic materials.
• Chemical Biology Probe Development: Utilized to create molecular probes and labeled compounds for studying enzyme mechanisms and biological pathways.
• Custom Synthesis & Contract Manufacturing: A critical starting material for fine chemical manufacturers offering bespoke synthesis services to the life sciences industry.

Basic Information

Item	Detail
Product Name	3-(2-Bromo-Phenylsulfanyl)-1,1,1-Trifluoro-Propan-2-Ol
CAS No.	958452-13-6
Molecular Formula	C9H8BrF3OS
Molecular Weight	301.12 g/mol
Synonyms	1,1,1-Trifluoro-3-[(2-bromophenyl)thio]-2-propanol; 2-Bromo-α-[(trifluoromethyl)hydroxymethyl]benzenemethanethiol; 3-[(2-Bromophenyl)thio]-1,1,1-trifluoro-2-propanol; 2-Bromophenyl 1,1,1-trifluoro-2-hydroxypropyl sulfide; 958452-13-6; 3-(2-Bromophenylthio)-1,1,1-trifluoropropan-2-ol
EINECS	Contact for details

Quality Control

Our production of 3-(2-Bromo-Phenylsulfanyl)-1,1,1-Trifluoro-Propan-2-Ol adheres to stringent quality management protocols to ensure batch-to-batch consistency and high purity. We employ advanced analytical techniques including HPLC, GC, NMR, and MS for comprehensive characterization and purity verification. A detailed Certificate of Analysis (COA) is provided with each shipment, documenting critical parameters such as assay, identity, and impurity profiles to support your regulatory and R&D requirements.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (typically 15-25°C). This compound may be moisture-sensitive; keep the container tightly sealed under an inert atmosphere if necessary. Keep away from strong oxidizing agents, strong bases, and heat sources.

Specification

Item	Specification
Appearance	White to off-white crystalline powder or solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Melting Point	Contact for details
Loss on Drying	≤ 0.5%
Residue on Ignition	≤ 0.1%
Heavy Metals	≤ 20 ppm

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