Cas no 2229130-74-7 (2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal)

2-Chloro-5-(1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl)propanal is a specialized intermediate in organic synthesis, featuring a pyrazole core substituted with chloro, methyl, and trifluoromethyl groups. Its structural complexity makes it valuable for constructing pharmacologically active compounds, particularly in agrochemical and pharmaceutical applications. The trifluoromethyl group enhances metabolic stability and lipophilicity, while the chloro substituent offers reactivity for further functionalization. This compound is particularly useful in the development of pyrazole-based derivatives, where its unique electronic and steric properties can influence biological activity. Its synthesis and handling require expertise due to its reactive aldehyde functionality and halogenated framework. Suitable for controlled laboratory use under appropriate safety protocols.
2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal structure
2229130-74-7 structure
Product Name:2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal
CAS No:2229130-74-7
MF:C8H8ClF3N2O
MW:240.610131263733
CID:5976288
PubChem ID:165688833
Update Time:2025-05-19

2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal Chemical and Physical Properties

Names and Identifiers

    • 2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal
    • EN300-1960325
    • 2-[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]propanal
    • 2229130-74-7
    • Inchi: 1S/C8H8ClF3N2O/c1-4(3-15)5-6(8(10,11)12)13-14(2)7(5)9/h3-4H,1-2H3
    • InChI Key: IWNVEEDVLPUMIE-UHFFFAOYSA-N
    • SMILES: ClC1=C(C(C(F)(F)F)=NN1C)C(C=O)C

Computed Properties

  • Exact Mass: 240.0277251g/mol
  • Monoisotopic Mass: 240.0277251g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 249
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.1
  • Topological Polar Surface Area: 34.9?2

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2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal Related Literature

Additional information on 2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal

Comprehensive Overview of 2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal (CAS No. 2229130-74-7)

The compound 2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal (CAS No. 2229130-74-7) is a specialized organic molecule that has garnered significant attention in the fields of pharmaceutical chemistry, agrochemical research, and material science. Its unique structural features, including the presence of a trifluoromethyl group and a pyrazole ring, make it a valuable intermediate for synthesizing more complex molecules. Researchers and industry professionals are increasingly exploring its potential applications, particularly in the development of novel therapeutics and crop protection agents.

One of the key reasons for the growing interest in 2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal is its versatility. The chloro and trifluoromethyl substituents on the pyrazole ring enhance its reactivity, allowing it to participate in a wide range of chemical transformations. This makes it an attractive building block for drug discovery and agrochemical formulation. Recent studies have highlighted its potential as a precursor for bioactive compounds with applications in treating metabolic disorders and infectious diseases.

In the context of sustainable chemistry, 2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal aligns with the global push toward green synthesis and eco-friendly chemical processes. Researchers are investigating ways to optimize its production using catalytic methods and renewable resources, reducing the environmental footprint associated with its synthesis. This focus on sustainability resonates with current trends in the chemical industry, where circular economy principles are gaining traction.

Another area of interest is the compound's potential role in advanced materials. The trifluoromethyl group is known to impart unique properties, such as increased thermal stability and hydrophobicity, which are desirable in high-performance polymers and electronic materials. As industries seek to develop next-generation materials for applications in flexible electronics and energy storage, 2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal could play a pivotal role.

From a market perspective, the demand for 2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal is expected to rise, driven by its applications in life sciences and specialty chemicals. Companies specializing in custom synthesis and fine chemicals are actively exploring its commercial potential. Additionally, the compound's patent landscape is being closely monitored, as innovations in its synthesis and applications could lead to intellectual property opportunities.

For researchers and professionals seeking detailed information about 2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal, it is essential to consult reliable scientific literature and technical databases. The compound's CAS No. 2229130-74-7 serves as a unique identifier, facilitating accurate searches across chemical databases and regulatory documents. As the scientific community continues to uncover its potential, 2-5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-ylpropanal is poised to become a cornerstone in modern chemical research and industrial applications.

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