Cas no 861586-14-3 (1H-Pyrazole-4-carboxamide,1,3,5-trimethyl-)

1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- is a substituted pyrazole derivative characterized by its trimethyl functional groups and carboxamide moiety. This compound is of interest in pharmaceutical and agrochemical research due to its potential as a versatile intermediate in synthetic chemistry. The presence of the carboxamide group enhances its reactivity, enabling its use in the development of biologically active molecules. Its structural features, including the electron-rich pyrazole core and sterically defined substitution pattern, contribute to its stability and selectivity in reactions. This compound is particularly valued for its utility in heterocyclic synthesis, where it serves as a building block for more complex molecular architectures. Its well-defined purity and consistent performance make it suitable for rigorous laboratory applications.
1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- structure
861586-14-3 structure
Product Name:1H-Pyrazole-4-carboxamide,1,3,5-trimethyl-
CAS No:861586-14-3
MF:C7H11N3O
MW:153.181740999222
MDL:MFCD11644024
CID:718349
Update Time:2025-06-13

1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrazole-4-carboxamide,1,3,5-trimethyl-
    • 1,3,5-Trimethyl-1H-pyrazole-4-carboxamide
    • 4-Pyrazolecarboxamide, 1,3,5-trimethyl- (2CI)
    • 4-Pyrazolecarboxamide, 1,3,5-trimethyl- (2CI)
    • 1H-Pyrazole-4-carboxamide, 1,3,5-trimethyl-
    • MDL： MFCD11644024
    • Inchi： 1S/C7H11N3O/c1-4-6(7(8)11)5(2)10(3)9-4/h1-3H3,(H2,8,11)
    • InChI Key： ALLQXNNDLWBTGF-UHFFFAOYSA-N
    • SMILES： N1(C)C(C)=C(C(N)=O)C(C)=N1

Computed Properties

  • Exact Mass: 153.09
  • Monoisotopic Mass: 153.09
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 171
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 60.9A^2

Experimental Properties

  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 252.9±40.0 °C at 760 mmHg
  • Flash Point: 106.8±27.3 °C
  • Vapor Pressure: 0.0±0.5 mmHg at 25°C
  • pka: 15.52±0.50(Predicted)

1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- Security Information

1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- Customs Data

  • HS CODE：2933119000

1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Apollo Scientific
OR110410-1g
1,3,5-Trimethyl-1H-pyrazole-4-carboxamide
 861586-14-3
1g
 ￡231.00 2023-09-02
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1396900-1g
1,3,5-Trimethyl-1H-pyrazole-4-carboxamide
 861586-14-3 95+%
1g
 ￥2563.00 2024-07-28
abcr
AB418675-1 g
1,3,5-Trimethyl-1H-pyrazole-4-carboxamide
 861586-14-3
1g
 €290.00 2022-03-02
Chemenu
CM526646-1g
1,3,5-Trimethyl-1H-pyrazole-4-carboxamide
 861586-14-3 95%
1g
 $347 2022-03-01
Crysdot LLC
CD11042381-1g
1,3,5-Trimethyl-1H-pyrazole-4-carboxamide
 861586-14-3 95+%
1g
 $347 2024-07-18
Ambeed
A303143-1g
1,3,5-Trimethyl-1H-pyrazole-4-carboxamide
 861586-14-3 95+%
1g
 $333.0 2025-04-16
abcr
AB418675-1g
1,3,5-Trimethyl-1H-pyrazole-4-carboxamide; .
 861586-14-3
1g
 €351.30 2025-04-16
Key Organics Ltd
AS-8547-1MG
1,3,5-trimethyl-1H-pyrazole-4-carboxamide
 861586-14-3 >90%
1mg
 ￡37.00 2025-02-09
Key Organics Ltd
AS-8547-5MG
1,3,5-trimethyl-1H-pyrazole-4-carboxamide
 861586-14-3 >90%
5mg
 ￡46.00 2025-02-09
Key Organics Ltd
AS-8547-10MG
1,3,5-trimethyl-1H-pyrazole-4-carboxamide
 861586-14-3 >90%
10mg
 ￡63.00 2025-02-09

1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:861586-14-3)1H-Pyrazole-4-carboxamide,1,3,5-trimethyl-
Order Number:A1182802
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 01:50
Price ($):300.0

1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- Related Literature

Additional information on 1H-Pyrazole-4-carboxamide,1,3,5-trimethyl-

Comprehensive Overview of 1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- (CAS No. 861586-14-3)

1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- (CAS No. 861586-14-3) is a specialized organic compound that has garnered significant attention in pharmaceutical and agrochemical research. This compound, characterized by its pyrazole backbone and carboxamide functional group, is widely studied for its potential applications in drug discovery and material science. Researchers are particularly interested in its structural versatility, which allows for modifications to enhance bioactivity and stability.

The 1,3,5-trimethyl substitution pattern on the pyrazole ring contributes to the compound's unique physicochemical properties, including solubility and thermal stability. These attributes make it a valuable intermediate in synthesizing more complex molecules. Recent studies have explored its role in developing kinase inhibitors, a hot topic in oncology research, as well as its potential use in crop protection agents, aligning with the growing demand for sustainable agriculture solutions.

In the context of AI-driven drug discovery, 1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- has been flagged as a promising scaffold for virtual screening. Computational models predict high binding affinity to specific protein targets, making it a candidate for personalized medicine applications. This aligns with current trends in precision healthcare, where tailored therapies are increasingly sought after.

From a synthetic chemistry perspective, the compound's carboxamide group offers reactivity that can be harnessed for further derivatization. This feature is particularly appealing in green chemistry initiatives, where minimizing waste and optimizing atom economy are priorities. Its compatibility with microwave-assisted synthesis—a technique gaining traction for its efficiency—further enhances its appeal to industrial and academic researchers alike.

Analytical challenges associated with 1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- include its characterization in complex matrices. Advanced techniques like LC-MS and NMR spectroscopy are often employed to ensure purity and confirm structural integrity. These methods are frequently searched by quality control professionals, reflecting the compound's relevance in high-standard manufacturing processes.

The compound's stability under various pH conditions has also been investigated, with implications for formulation science. This is critical for developing oral or topical medications, a subject of intense interest given the rise of self-administration trends in healthcare. Such studies often appear in searches related to excipient compatibility and drug delivery systems.

In material science, the pyrazole core of 1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- has shown potential in designing organic semiconductors. This application taps into the booming field of flexible electronics, a frequent search topic among engineers and material scientists. The compound's ability to form stable thin films could contribute to next-generation wearable technology.

Regulatory aspects of 1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- are frequently queried in professional forums. While not classified as hazardous under current guidelines, proper laboratory handling protocols are emphasized in safety data sheets. This information is crucial for compliance with Good Manufacturing Practice (GMP) standards, a perennial concern in chemical industries.

The compound's patent landscape reveals ongoing innovation, particularly in combination therapies for chronic diseases. This intersects with popular searches about synergistic drug effects and polypharmacy management. Intellectual property databases show increasing filings involving derivatives of 1H-Pyrazole-4-carboxamide,1,3,5-trimethyl-, indicating its commercial potential.

Environmental fate studies of 1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- have gained attention amid concerns about microbial degradation of synthetic compounds. Research into its biodegradation pathways addresses the pressing need for eco-friendly chemicals, a dominant theme in contemporary environmental science discussions.

Supply chain dynamics for 861586-14-3 reflect broader trends in specialty chemicals procurement. With increasing demand for high-purity intermediates, suppliers are optimizing synthesis routes to ensure consistent quality. These operational aspects frequently appear in procurement-related searches from pharmaceutical developers.

In academic settings, 1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- serves as an excellent case study for teaching heterocyclic chemistry principles. Its well-defined reactivity patterns make it ideal for demonstrating nucleophilic substitution and ring formation reactions—fundamental concepts that chemistry students often search for clarification on.

The compound's spectral data (IR, 1H NMR, 13C NMR) are frequently requested in research circles, highlighting the importance of analytical method validation in chemical characterization. These datasets are crucial for reproducibility in synthetic chemistry, a cornerstone of the open science movement gaining momentum globally.

Looking ahead, 1H-Pyrazole-4-carboxamide,1,3,5-trimethyl- is poised to maintain its relevance across multiple disciplines. Its adaptability to both traditional and cutting-edge applications ensures continued interest from diverse scientific communities addressing some of today's most pressing technological and medical challenges.

861586-14-3 (1H-Pyrazole-4-carboxamide,1,3,5-trimethyl-) Related Products

Recommended suppliers
Amadis Chemical Company Limited
(CAS:861586-14-3)1H-Pyrazole-4-carboxamide,1,3,5-trimethyl-
A1182802
Purity:99%
Quantity:1g
Price ($):300.0
Email