Cas no 119458-46-7 (Methyl 1-Ethyl-1H-pyrazole-5-carboxylate)

Methyl 1-Ethyl-1H-pyrazole-5-carboxylate is a pyrazole-based ester compound with applications in pharmaceutical and agrochemical synthesis. Its structure features a carboxylate group at the 5-position and an ethyl substituent on the nitrogen, enhancing reactivity and versatility in heterocyclic chemistry. The compound serves as a key intermediate in the preparation of biologically active molecules, including potential drug candidates and crop protection agents. Its stability under standard conditions and compatibility with various reaction conditions make it a practical choice for synthetic workflows. The ester functionality allows for further derivatization, enabling tailored modifications for target applications.
Methyl 1-Ethyl-1H-pyrazole-5-carboxylate structure
119458-46-7 structure
Product Name:Methyl 1-Ethyl-1H-pyrazole-5-carboxylate
CAS No:119458-46-7
MF:C7H10N2O2
MW:154.166501522064
MDL:MFCD13174882
CID:132200
PubChem ID:14089974
Update Time:2025-10-24

Methyl 1-Ethyl-1H-pyrazole-5-carboxylate Chemical and Physical Properties

Names and Identifiers

    • 1-ethyl-1H-Pyrazole-5-carboxylic acid methyl ester
    • 1H-Pyrazole-5-carboxylicacid, 1-ethyl-, methyl ester
    • methyl 2-ethylpyrazole-3-carboxylate
    • METHYL 1-ETHYL-1H-PYRAZOLE-5-CARBOXYLATE
    • 1H-Pyrazole-5-carboxylicacid,1-ethyl-,methylester(9CI)
    • 2-ethyl-3-methoxycarbonylpyrazole
    • EN300-232529
    • AKOS005169455
    • CS-0208196
    • 119458-46-7
    • Methyl1-Ethyl-1H-pyrazole-5-carboxylate
    • BS-26637
    • DTXSID00555707
    • SCHEMBL24937400
    • Methyl 1-Ethyl-1H-pyrazole-5-carboxylate
    • MDL: MFCD13174882
    • Inchi: 1S/C7H10N2O2/c1-3-9-6(4-5-8-9)7(10)11-2/h4-5H,3H2,1-2H3
    • InChI Key: JNPIKIIETKZOLK-UHFFFAOYSA-N
    • SMILES: O(C)C(C1=CC=NN1CC)=O

Computed Properties

  • Exact Mass: 154.074227566g/mol
  • Monoisotopic Mass: 154.074227566g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 3
  • Complexity: 149
  • 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
  • XLogP3: 0.7
  • Topological Polar Surface Area: 44.1?2

Methyl 1-Ethyl-1H-pyrazole-5-carboxylate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
CHENG DOU FEI BO YI YAO Technology Co., Ltd.
FC13769-25g
methyl 1-ethyl-1H-pyrazole-5-carboxylate
119458-46-7 95%
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$2550 2023-09-07
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$ 95.00 2022-06-07
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$ 340.00 2022-06-07
Apollo Scientific
OR945550-250mg
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£167.00 2025-02-21
Apollo Scientific
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abcr
AB444869-250 mg
Methyl 1-ethyl-1H-pyrazole-5-carboxylate; min. 95%
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€195.90 2022-03-02
abcr
AB444869-500 mg
Methyl 1-ethyl-1H-pyrazole-5-carboxylate; min. 95%
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€232.80 2022-03-02
abcr
AB444869-1 g
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abcr
AB444869-5 g
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Additional information on Methyl 1-Ethyl-1H-pyrazole-5-carboxylate

Comprehensive Overview of Methyl 1-Ethyl-1H-pyrazole-5-carboxylate (CAS No. 119458-46-7)

Methyl 1-Ethyl-1H-pyrazole-5-carboxylate (CAS No. 119458-46-7) is a versatile organic compound widely utilized in pharmaceutical and agrochemical research. This ester derivative of pyrazole has garnered significant attention due to its unique chemical properties and potential applications in drug discovery and material science. The compound's molecular structure, featuring a pyrazole ring substituted with an ethyl group and a carboxylate ester, makes it a valuable intermediate in synthetic chemistry.

In recent years, the demand for pyrazole derivatives like Methyl 1-Ethyl-1H-pyrazole-5-carboxylate has surged, driven by their role in developing novel therapeutics and functional materials. Researchers are particularly interested in its potential as a building block for heterocyclic compounds, which are pivotal in designing kinase inhibitors and anti-inflammatory agents. The compound's CAS No. 119458-46-7 is frequently searched in academic databases, reflecting its relevance in cutting-edge studies.

The synthesis of Methyl 1-Ethyl-1H-pyrazole-5-carboxylate typically involves the condensation of hydrazine derivatives with β-ketoesters, followed by esterification. This process is optimized for high yield and purity, ensuring its suitability for industrial-scale production. Its molecular formula (C7H10N2O2) and molecular weight (154.17 g/mol) are critical parameters for researchers working on structure-activity relationships (SAR) in medicinal chemistry.

One of the trending topics associated with this compound is its application in green chemistry. With growing emphasis on sustainable practices, scientists are exploring eco-friendly synthetic routes for Methyl 1-Ethyl-1H-pyrazole-5-carboxylate, such as catalytic methods or solvent-free reactions. These advancements align with global efforts to reduce the environmental footprint of chemical manufacturing.

Another area of interest is the compound's role in crop protection. Agrochemical companies are investigating pyrazole-based compounds for their herbicidal and fungicidal properties. The 1-ethyl-1H-pyrazole moiety, in particular, has shown promise in enhancing the efficacy of pest control formulations, addressing the urgent need for safer and more efficient agricultural solutions.

From a commercial perspective, Methyl 1-Ethyl-1H-pyrazole-5-carboxylate is available in various purity grades, catering to diverse research needs. Suppliers often highlight its storage stability and compatibility with common organic solvents, making it a practical choice for laboratory use. The compound's spectroscopic data (e.g., NMR, IR) is well-documented, facilitating its identification and quality control.

In the context of drug discovery, this compound serves as a precursor for bioactive molecules targeting neurological and metabolic disorders. Its modifiable functional groups allow for extensive derivatization, enabling the creation of libraries for high-throughput screening. This adaptability is crucial in the race to develop new treatments for diseases like diabetes and Alzheimer's.

As the scientific community continues to explore the potential of Methyl 1-Ethyl-1H-pyrazole-5-carboxylate, its CAS No. 119458-46-7 remains a focal point in patent literature and research publications. The compound's versatility ensures its enduring relevance in both academic and industrial settings, solidifying its position as a key player in modern chemistry.

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