Description

1-Isothiocyanato-2-Methyl-3-Nitrobenzene is a specialized aromatic isothiocyanate derivative, identified by CAS NO 956576-79-7, serving as a high-value chemical intermediate. Its unique structure, combining an isothiocyanate functional group with methyl and nitro substituents, makes it a critical building block for synthesizing complex heterocyclic compounds and functional materials. This compound is primarily sought by research and development teams in the pharmaceutical and agrochemical sectors for creating novel active ingredients and advanced chemical entities.

Application

• Pharmaceutical Intermediate: A key precursor in the synthesis of novel benzothiazole and benzimidazole derivatives with potential biological activity.
• Agrochemical Synthesis: Used in the research and development of new herbicides, fungicides, and plant growth regulators.
• Material Science: Serves as a monomer or cross-linking agent in the development of specialized polymers and advanced functional materials.
• Chemical Research: Employed in academic and industrial laboratories for studying heterocyclic chemistry and developing new synthetic methodologies.
• Dye and Pigment Intermediate: Acts as a building block for synthesizing complex organic dyes and colorants.
• Ligand Synthesis: Used to prepare specialized ligands for catalysis and metal-organic frameworks (MOFs).

Basic Information

Product Name	1-Isothiocyanato-2-Methyl-3-Nitrobenzene
CAS No.	956576-79-7
Molecular Formula	C8H6N2O2S
Molecular Weight	194.21 g/mol
Synonyms	2-Methyl-3-nitro-1-isothiocyanatobenzene; 2-Methyl-3-nitrobenzene isothiocyanate; 3-Nitro-2-methylphenyl isothiocyanate; 1-Isothiocyanato-2-methyl-3-nitrobenzene; NSC 406916; (2-Methyl-3-nitrophenyl) isothiocyanate; 2-Methyl-3-nitrophenyl isothiocyanate; 1-Isothiocyanato-2-methyl-3-nitro-benzene
EINECS	Contact for details

Quality Control

Our 1-Isothiocyanato-2-Methyl-3-Nitrobenzene is manufactured under strict quality management systems. Every batch undergoes rigorous analytical testing, including HPLC, GC, and NMR, to ensure identity, purity, and consistency. A comprehensive Certificate of Analysis (COA) detailing all specifications is provided with each shipment to support your quality assurance and regulatory requirements.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, well-ventilated area at a controlled room temperature (15-25°C). Due to its hygroscopic nature, the container must be kept tightly sealed to exclude moisture. Keep away from heat, sparks, and open flame.

Specification

Item	Specification
Appearance	Yellow to orange crystalline powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Melting Point	Contact for details
Loss on Drying	≤ 1.0%
Residue on Ignition	≤ 0.1%

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