Cas no 953726-60-8 (2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile)

2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile structure
953726-60-8 structure
Product Name:2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile
CAS No:953726-60-8
MF:C9H7F3N2S
MW:232.225490808487
CID:5229645
PubChem ID:16786184
Update Time:2025-10-29

2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile Chemical and Physical Properties

Names and Identifiers

    • Benzeneacetonitrile, α-amino-4-[(trifluoromethyl)thio]-
    • 2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile
    • Inchi: 1S/C9H7F3N2S/c10-9(11,12)15-7-3-1-6(2-4-7)8(14)5-13/h1-4,8H,14H2
    • InChI Key: GCRYPQGJURZRBT-UHFFFAOYSA-N
    • SMILES: C1C(C(N)C#N)=CC=C(SC(F)(F)F)C=1

2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-180623-0.05g
2-amino-2-{4-[(trifluoromethyl)sulfanyl]phenyl}acetonitrile
953726-60-8
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$732.0 2023-09-19
Enamine
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Enamine
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2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile Related Literature

Additional information on 2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile

Comprehensive Overview of 2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile (CAS No. 953726-60-8)

2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile (CAS No. 953726-60-8) is a specialized organic compound that has garnered significant attention in pharmaceutical and agrochemical research. This nitrile derivative features a unique combination of functional groups, including an amino group and a trifluoromethylsulfanyl moiety, which contribute to its versatile reactivity and potential applications. The compound's molecular structure makes it particularly valuable in the synthesis of heterocyclic compounds, which are crucial in drug discovery and material science.

The growing interest in fluorinated compounds and sulfur-containing molecules has positioned 2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile as a key intermediate in modern synthetic chemistry. Researchers are increasingly exploring its utility in the development of bioactive molecules, particularly in the context of antimicrobial agents and enzyme inhibitors. Its structural features align with current trends in medicinal chemistry, where the incorporation of fluorine atoms and sulfur groups is known to enhance metabolic stability and binding affinity.

From a synthetic perspective, 2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile serves as a valuable building block for the construction of more complex molecular architectures. Its acetonitrile framework allows for diverse chemical transformations, including nucleophilic additions and cyclization reactions. This flexibility has made it a subject of interest in the development of new synthetic methodologies, particularly those aimed at improving atom economy and reducing environmental impact – key concerns in contemporary green chemistry initiatives.

The compound's physicochemical properties have been carefully studied to understand its behavior in various solvent systems and reaction conditions. With a molecular weight of 246.25 g/mol, this crystalline solid demonstrates moderate solubility in common organic solvents, a characteristic that facilitates its handling in laboratory settings. The presence of both electron-withdrawing (trifluoromethylsulfanyl) and electron-donating (amino) groups creates an interesting electronic profile that influences its reactivity patterns.

In the pharmaceutical sector, derivatives of 2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile have shown promise in preliminary biological screenings. The compound's scaffold has been investigated for potential central nervous system activity, with particular focus on neurological disorders that represent significant unmet medical needs. This aligns with current research priorities in the healthcare industry, where there is growing demand for novel therapeutic agents targeting neurodegenerative conditions.

The agrochemical industry has also shown interest in 2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile and its derivatives. The combination of fluorine and sulfur in its structure suggests potential applications in the development of new crop protection agents. With increasing global focus on sustainable agriculture and reduced environmental impact of pesticides, this compound represents an interesting starting point for the design of more selective and biodegradable agrochemicals.

From a commercial perspective, the availability of 2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile (CAS No. 953726-60-8) remains limited to specialized chemical suppliers catering to research and development needs. The compound's niche applications and specialized nature contribute to its premium pricing in the fine chemicals market. However, as research into its potential expands, we may see increased production and broader commercial availability in the future.

Quality control and characterization of 2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile typically involve advanced analytical techniques. High-performance liquid chromatography (HPLC), nuclear magnetic resonance (NMR) spectroscopy, and mass spectrometry are commonly employed to verify the compound's purity and structural integrity. These analytical protocols are essential for ensuring reproducible results in research applications and maintaining the high standards required in pharmaceutical development.

The safety profile of 2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile has been evaluated through standard laboratory testing. While comprehensive toxicological data may be limited due to its specialized nature, standard precautions for handling organic compounds should be observed. This includes the use of appropriate personal protective equipment and adequate ventilation when working with the substance in laboratory environments.

Looking ahead, the scientific community anticipates continued exploration of 2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile's potential. Its unique structural features position it as a valuable tool in the development of innovative materials and bioactive compounds. As synthetic methodologies advance and our understanding of structure-activity relationships deepens, this compound may play an increasingly important role in addressing current challenges in medicinal chemistry and materials science.

For researchers interested in working with 2-amino-2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile, it's important to consult recent literature for the latest developments in its applications and synthetic utility. The compound's versatility suggests that novel uses may continue to emerge as chemical research progresses, particularly in areas such as catalysis, material science, and drug discovery.

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