Description

3-Octyl-2-Sulfanylidene-1,3-Diazinan-4-One is a specialized heterocyclic organic compound featuring a diazinanone core with an octyl side chain and a thiocarbonyl group. This unique molecular structure makes it a valuable intermediate and building block for advanced chemical synthesis, particularly in the development of pharmaceuticals and agrochemicals. It is primarily sought by R&D chemists and process development scientists in the fine chemical, pharmaceutical, and agrochemical industries for creating novel active ingredients and functional materials.

Application

• Pharmaceutical Intermediate: A key synthon in the research and development of new drug candidates, particularly those targeting neurological or metabolic pathways.
• Agrochemical Synthesis: Used as a precursor in the manufacture of advanced pesticides, herbicides, and plant growth regulators.
• Ligand and Catalyst Development: Serves as a starting material for creating novel ligands used in transition metal catalysis and asymmetric synthesis.
• Material Science Research: Investigated for the synthesis of specialty polymers and advanced organic materials with specific thermal or electronic properties.
• Chemical Biology Probes: Utilized in the design and synthesis of molecular probes for studying enzyme mechanisms and biological pathways.

Basic Information

Product Name	3-Octyl-2-Sulfanylidene-1,3-Diazinan-4-One
CAS No.	5540-66-9
Molecular Formula	C12H22N2OS
Molecular Weight	242.38 g/mol
Synonyms	3-Octyl-2-thioxo-1,3-diazinan-4-one; 2-Thioxo-3-octylperhydro-4-pyrimidinone; 3-Octyl-2-thioxohexahydro-4-pyrimidinone; 4(1H)-Pyrimidinone, 3-octyl-1,4,5,6-tetrahydro-2-thioxo-; 3-n-Octyl-2-thioxo-1,3-diazinan-4-one; 2-Thioxo-3-octyl-1,3-diazinan-4-one; Octylthiodiazinanone
EINECS	Contact for details

Quality Control

Our 3-Octyl-2-Sulfanylidene-1,3-Diazinan-4-One is manufactured under strict quality management systems. Every batch undergoes rigorous analytical testing, including HPLC, NMR, and IR spectroscopy, to ensure identity, purity, and consistency. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing all critical quality parameters. Our commitment to quality supports your R&D and scale-up processes with reliable, high-purity material.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at a controlled room temperature (15-25°C). Keep away from heat, sparks, and open flame. For long-term storage, consider under an inert atmosphere to maintain optimal stability.

Specification

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

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