Cas no 925606-77-5 (3-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoic acid)

3-5-Methyl-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoic acid is a fluorinated pyrazole derivative with notable applications in pharmaceutical and agrochemical research. Its structure features a trifluoromethyl group, enhancing metabolic stability and lipophilicity, which is advantageous in drug design. The propanoic acid moiety provides a functional handle for further derivatization, making it a versatile intermediate. This compound exhibits potential as a building block for bioactive molecules, particularly in the development of enzyme inhibitors or receptor modulators. Its stability under physiological conditions and compatibility with common synthetic methodologies further underscore its utility in medicinal chemistry and material science applications.
3-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoic acid structure
925606-77-5 structure
Product Name:3-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoic acid
CAS No:925606-77-5
MF:C8H9F3N2O2
MW:222.164472341537
MDL:MFCD03419693
CID:3056955
PubChem ID:6485413
Update Time:2025-05-24

3-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-(5-Methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)propanoic acid
    • 3-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoic acid
    • MDL: MFCD03419693
    • Inchi: 1S/C8H9F3N2O2/c1-5-4-6(8(9,10)11)12-13(5)3-2-7(14)15/h4H,2-3H2,1H3,(H,14,15)
    • InChI Key: IQEOMEFTMGDULB-UHFFFAOYSA-N
    • SMILES: FC(C1C=C(C)N(CCC(=O)O)N=1)(F)F

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4

3-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoic acid Security Information

  • Hazard Category Code: 25
  • Safety Instruction: 45
  • Hazardous Material Identification: Xi T
  • HazardClass:IRRITANT

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3-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoic acid Related Literature

Additional information on 3-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoic acid

3-5-Methyl-3-(Trifluoromethyl)-1H-Pyrazol-1-Ylpropanoic Acid: A Comprehensive Overview

The compound with CAS No. 925606-77-5, known as 3-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoic acid, has emerged as a significant molecule in the field of organic chemistry and drug discovery. This compound, characterized by its unique structure and versatile functional groups, has garnered attention due to its potential applications in pharmaceuticals, agrochemicals, and materials science. The pyrazole ring at the core of this molecule is a key feature, contributing to its stability and reactivity. Recent studies have highlighted its role in modulating biological pathways, making it a promising candidate for therapeutic interventions.

3-5-Methyl-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoic acid is synthesized through a series of well-established organic reactions, including nucleophilic substitutions and cyclizations. The presence of the trifluoromethyl group enhances the molecule's lipophilicity, which is crucial for its bioavailability. Additionally, the methyl group at position 5 of the pyrazole ring contributes to steric effects, influencing the compound's interactions with biological targets. Recent advancements in asymmetric synthesis have enabled the production of enantiomerically pure forms of this compound, opening new avenues for stereo-specific drug design.

The pharmacological profile of 3-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-ylpropanoic acid has been extensively studied in preclinical models. It exhibits potent activity against various enzymes and receptors implicated in diseases such as cancer, inflammation, and neurodegenerative disorders. For instance, studies published in high-impact journals like *Nature Communications* and *Journal of Medicinal Chemistry* have demonstrated its ability to inhibit key oncogenic pathways and modulate neurotransmitter systems. These findings underscore its potential as a lead compound for drug development.

In terms of applications, 3-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yli propanoic acid has shown promise in agrochemicals due to its ability to act as a plant growth regulator. Field trials conducted in collaboration with agricultural research institutions have indicated improved crop yields under stress conditions such as drought and pest infestation. Furthermore, its compatibility with existing agricultural practices makes it a viable option for sustainable farming solutions.

From a materials science perspective, the compound's unique electronic properties make it an attractive candidate for use in organic electronics. Researchers at leading universities have explored its potential as a component in organic light-emitting diodes (OLEDs) and photovoltaic devices. Preliminary results suggest that it could enhance device efficiency by improving charge transport properties.

Looking ahead, ongoing research into 3-CAS No. 925606_77_5 focuses on optimizing its pharmacokinetic properties to improve therapeutic efficacy. Collaborative efforts between academia and industry are expected to yield breakthroughs in its clinical development. As the scientific community continues to unravel the full potential of this compound, it is poised to make significant contributions across multiple disciplines.

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