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Tricyclo[3.3.1.13,7]Decane, 1-Isothiocyanato-3,5-Dimethyl- (9Ci) CAS NO 136860-49-6


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CAS No.:136860-49-6

Grade:Pharmacy Grade

Content:99.9%

Brand:Customizable

Packaging:Customizable

Description

Tricyclo[3.3.1.13,7]Decane, 1-Isothiocyanato-3,5-Dimethyl- (9Ci) is a specialized chemical building block featuring a unique adamantane-derived core functionalized with an isothiocyanate group. This compound is valued for its role as a versatile intermediate in advanced organic synthesis, enabling the introduction of the reactive isothiocyanate moiety into complex molecular architectures. It is primarily sought by researchers and manufacturers in the pharmaceutical and agrochemical industries for the development of novel active ingredients and functional materials.

Application

  • Pharmaceutical Intermediate: Serves as a key precursor in the synthesis of novel drug candidates, particularly for creating thiourea derivatives with potential biological activity.
  • Agrochemical Research: Used in the development of new pesticides and herbicides, where the adamantane structure can impart stability and unique modes of action.
  • Material Science: Acts as a functional monomer or cross-linking agent in the production of specialty polymers and resins with enhanced thermal or mechanical properties.
  • Chemical Synthesis: Employed in organic chemistry as a building block for constructing complex, three-dimensional molecular scaffolds for various research applications.
  • Ligand and Catalyst Development: Utilized to create novel ligands for catalysis or metal-organic frameworks (MOFs) due to its rigid, multi-functional structure.

Basic Information

Item Details
Product Name Tricyclo[3.3.1.13,7]Decane, 1-Isothiocyanato-3,5-Dimethyl- (9Ci)
CAS No. 136860-49-6
Molecular Formula C13H19NS
Molecular Weight 221.36 g/mol
Synonyms 1-Isothiocyanato-3,5-dimethyladamantane; 3,5-Dimethyl-1-adamantyl isothiocyanate; 1-Isothiocyanato-3,5-dimethyltricyclo[3.3.1.13,7]decane; NSC 339242; Adamantane, 1-isothiocyanato-3,5-dimethyl-; 3,5-Dimethyladamantane-1-isothiocyanate
EINECS Contact for details

Quality Control

Every batch of Tricyclo[3.3.1.13,7]Decane, 1-Isothiocyanato-3,5-Dimethyl- (9Ci) is produced and tested under strict quality management protocols to ensure high purity and consistency. Our standard analytical suite includes identification by spectroscopic methods (IR, NMR), purity assessment by HPLC or GC, and determination of moisture content. A comprehensive Certificate of Analysis (COA) detailing all test results is provided with each shipment to guarantee compliance with your research or production specifications.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at room temperature (15-25°C). Due to its hygroscopic (moisture-sensitive) nature, the container must be kept tightly sealed after opening to prevent degradation from atmospheric moisture. Keep away from incompatible materials such as strong bases and oxidizing agents.

Specification

Item Specification
Appearance White to off-white crystalline powder
Identification (IR) Conforms to structure
Purity (HPLC/GC) ≥ 97.0%
Melting Point Contact for details
Loss on Drying ≤ 1.0%

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

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