Description

4,4-Difluoroadamantan-1-Carboxylic Acid Methyl Ester is a high-value, fluorinated adamantane derivative that serves as a critical building block in advanced organic synthesis. This compound is prized for its unique structural rigidity and the introduction of fluorine atoms, which are essential for modulating the physicochemical and biological properties of target molecules. It is primarily sought after by research chemists and process development scientists in the pharmaceutical and agrochemical industries for applications in medicinal chemistry and material science.

Application

• Pharmaceutical Intermediate: A key synthon for the development of novel active pharmaceutical ingredients (APIs), particularly in antiviral, neurological, and anti-inflammatory drug discovery programs.
• Agrochemical Research: Used in the synthesis of advanced crop protection agents and pesticides, where the adamantane core can enhance stability and bioavailability.
• Material Science Precursor: Serves as a monomer or cross-linking agent for developing specialty polymers, resins, and coatings with enhanced thermal and chemical resistance.
• Ligand and Catalyst Development: Employed in organometallic chemistry to create novel ligands and catalysts for asymmetric synthesis and other catalytic processes.
• Fluorine Chemistry Studies: An important reagent for investigating structure-activity relationships (SAR) and the effects of fluorination in molecular design.
• High-Purity Reference Standard: Supplied as a certified reference material for analytical method development and quality control in regulated industries.

Basic Information

Product Name	4,4-Difluoroadamantan-1-Carboxylic Acid Methyl Ester
CAS No.	1313739-04-6
Molecular Formula	C13H18F2O2
Molecular Weight	244.28 g/mol
Synonyms	Methyl 4,4-difluoroadamantane-1-carboxylate; 1-Carbomethoxy-4,4-difluoroadamantane; 4,4-Difluoroadamantane-1-carboxylic acid methyl ester; 4,4-Difluorotricyclo[3.3.1.13,7]decane-1-carboxylic acid methyl ester; Methyl 4,4-difluorotricyclo[3.3.1.13,7]decane-1-carboxylate; 4,4-Difluoroadamantyl-1-methyl carboxylate; Difluoroadamantane methyl ester
EINECS	Contact for details

Quality Control

Our 4,4-Difluoroadamantan-1-Carboxylic Acid Methyl Ester is manufactured under strict quality management systems. Each batch undergoes comprehensive analytical testing, including HPLC, GC, NMR, and MS, to ensure identity, purity, and consistency. We provide a detailed Certificate of Analysis (COA) with every shipment, documenting all critical quality attributes. Our production adheres to cGMP principles where applicable, ensuring reliability for research and scale-up activities.

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). Keep away from incompatible materials such as strong bases and fluorides. For long-term storage, consider storing under an inert atmosphere to maintain optimal purity.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Related Substances (HPLC)	Total impurities ≤ 3.0%
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.