Description

4-Isocyanato-1,2,3,5,6,7-hexahydro-s-indacene is a specialized isocyanate derivative of the hexahydro-s-indacene scaffold, serving as a critical building block in advanced organic synthesis. Its primary value lies in its highly reactive isocyanate (-NCO) group, which enables efficient formation of ureas, carbamates, and other functional materials through reactions with amines, alcohols, and other nucleophiles. This compound is essential for researchers and manufacturers in the pharmaceutical, agrochemical, and materials science industries who require a versatile and high-purity intermediate for constructing complex molecular architectures.

Application

• Pharmaceutical Intermediate: Key precursor in the synthesis of active pharmaceutical ingredients (APIs), particularly for candidates targeting central nervous system (CNS) disorders or inflammation.
• Agrochemical Synthesis: Used in the development of novel herbicides, fungicides, and insecticides, leveraging the indacene core for bioactivity.
• Polymer & Material Science: Serves as a monomer or cross-linking agent in the production of specialty polyurethanes, coatings, adhesives, and high-performance polymers.
• Chemical Research & Development: A valuable reagent in medicinal chemistry and process R&D for creating novel compound libraries and exploring new synthetic pathways.
• Ligand & Catalyst Development: The rigid indacene structure can be functionalized to create novel ligands for catalysis or molecular recognition applications.

Basic Information

Product Name	4-Isocyanato-1,2,3,5,6,7-hexahydro-s-indacene
CAS No.	210827-31-9
Molecular Formula	C13H13NO
Molecular Weight	199.25 g/mol
Synonyms	4-Isocyanato-1,2,3,5,6,7-hexahydro-s-indacene; 1,2,3,5,6,7-Hexahydro-s-indacen-4-yl isocyanate; 4-Isocyanatohexahydro-s-indacene; s-Indacene-4-isocyanate, hexahydro-; Hexahydro-s-indacen-4-yl isocyanate; 210827-31-9; 4-NCO-hexahydro-s-indacene
EINECS	Contact for details

Quality Control

Our 4-Isocyanato-1,2,3,5,6,7-hexahydro-s-indacene is manufactured under strict quality control protocols to ensure batch-to-batch consistency and high purity. Each lot is analyzed using advanced techniques including HPLC, GC, NMR, and IR spectroscopy. A comprehensive Certificate of Analysis (COA) detailing purity, identity, and impurity profiles is provided with every shipment. We support cGMP and ISO 9001 standards for pharmaceutical and industrial 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 product is hygroscopic (moisture-sensitive) and should be handled under a dry inert atmosphere (e.g., nitrogen or argon) to prevent degradation. Keep away from heat, open flames, and sources of ignition.

Specification

Item	Specification
Appearance	White to off-white crystalline solid or powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 97.0% (Standard Grade)
Purity (GC)	≥ 97.0%
Water Content (KF)	≤ 0.5%
Solvent Residue (GC)	Meets ICH guidelines

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