Description

3-Nitrophenacyl Thiocyanate is a versatile organic building block characterized by its reactive nitrophenacyl and thiocyanate functional groups. This compound is valued for its role as a key intermediate in the synthesis of more complex heterocyclic and pharmaceutical molecules. It is primarily utilized by research chemists and process development teams in the pharmaceutical, agrochemical, and specialty chemical industries for constructing novel molecular scaffolds.

Application

• Pharmaceutical Intermediate: Serves as a critical precursor in the synthesis of potential drug candidates and active pharmaceutical ingredients (APIs), particularly those containing sulfur or nitrogen heterocycles.
• Agrochemical Synthesis: Used in research and development for creating novel herbicides, fungicides, and insecticides, leveraging its reactive sites for structural diversification.
• Organic Synthesis Building Block: Employed in academic and industrial R&D for constructing complex organic molecules, including dyes, pigments, and functional materials.
• Chemical Biology Probe Development: Acts as a starting material for synthesizing probes and reagents used in biochemical and bioconjugation studies.
• Material Science Research: Investigated for its potential use in the development of advanced polymers or organic electronic materials due to its electron-withdrawing nitro group.

Basic Information

Product Name	3-Nitrophenacyl Thiocyanate
CAS No.	6097-22-9
Molecular Formula	C9H6N2O3S
Molecular Weight	222.22 g/mol
Synonyms	1-(3-Nitrophenyl)-2-thiocyanatoethanone; 3-Nitro-ω-thiocyanatoacetophenone; 2-Thiocyanato-1-(3-nitrophenyl)ethanone; Phenacyl thiocyanate, 3-nitro-; 3-Nitrobenzoyl methyl thiocyanate; 3-Nitrophenacyl rhodanide; α-Thiocyanato-3-nitroacetophenone; 6097-22-9
EINECS	Contact for details

Quality Control

Our 3-Nitrophenacyl Thiocyanate is manufactured under a strict quality management system. Each batch undergoes comprehensive analytical testing, including HPLC, NMR, and FTIR, to ensure identity, purity, and consistency. A detailed Certificate of Analysis (COA) is provided with every shipment, confirming compliance with agreed specifications. We support cGMP and ISO standards for research and development applications.

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). This material is easily oxidized and should be handled under an inert atmosphere for long-term storage. Keep away from heat, sparks, and open flame.

Specification

Item	Specification
Appearance	Yellow to light brown crystalline powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Melting Point	Contact for details
Loss on Drying	≤ 1.0%
Residue on Ignition	≤ 0.5%

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