Description

3-(Trifluoromethyl)Benzyl Thiocyanate is a specialized organic building block featuring a benzyl thiocyanate group substituted with a trifluoromethyl moiety. This compound is valued for its unique reactivity, serving as a versatile intermediate for introducing the thiocyanate functional group into more complex molecular architectures. It is primarily sought by research chemists and process development scientists in the pharmaceutical and agrochemical industries for the synthesis of novel active ingredients and functional materials.

Application

• Pharmaceutical Intermediate: Key synthon for constructing molecules with potential biological activity, particularly in drug discovery programs.
• Agrochemical Synthesis: Used in the research and development of new herbicides, fungicides, and insecticides.
• Ligand and Catalyst Development: Serves as a precursor for synthesizing specialized ligands used in coordination chemistry and catalysis.
• Material Science Research: Employed in the creation of novel polymers or organic electronic materials with specific properties.
• Chemical Biology Probes: Useful for modifying biomolecules or creating activity-based probes for enzyme studies.
• Custom Synthesis: A starting material for contract research organizations (CROs) and fine chemical manufacturers producing bespoke compounds.

Basic Information

Product Name	3-(Trifluoromethyl)Benzyl Thiocyanate
CAS No.	102859-64-3
Molecular Formula	C9H6F3NS
Molecular Weight	217.21 g/mol
Synonyms	α-(Trifluoromethyl)-benzylthiocyanate; (3-(Trifluoromethyl)phenyl)methyl thiocyanate; m-(Trifluoromethyl)benzyl thiocyanate; 3-(Trifluoromethyl)phenylmethyl thiocyanate; 1-(Thiocyanatomethyl)-3-(trifluoromethyl)benzene; Benzene, 1-(thiocyanatomethyl)-3-(trifluoromethyl)-; Thiocyanic acid, (3-(trifluoromethyl)phenyl)methyl ester
EINECS	Contact for details

Quality Control

Our 3-(Trifluoromethyl)Benzyl Thiocyanate is manufactured under strict quality management protocols. Each batch undergoes comprehensive analytical testing, including chromatographic purity assays and structural confirmation, to ensure it meets the high standards required for research and development applications. A Certificate of Analysis (COA) detailing purity, identity, and other critical parameters is provided with every shipment.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, well-ventilated area at room temperature (15-25°C). Keep away from heat, sparks, and open flame. This material is light-sensitive (store away from light).

Specification

Item	Specification
Appearance	White to off-white crystalline powder or solid
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Melting Point	Contact for details

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