Cas no 1305320-57-3 (Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride)

Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride is a pyrazole derivative with applications in pharmaceutical and agrochemical research. This compound serves as a versatile intermediate in the synthesis of heterocyclic compounds due to its reactive carboxylate and pyrazole functionalities. The hydrochloride salt enhances stability and solubility, facilitating handling and storage. Its well-defined structure and high purity make it suitable for use in medicinal chemistry, particularly in the development of bioactive molecules. The ethyl ester group provides additional reactivity for further derivatization. This product is characterized by consistent quality, making it a reliable choice for research and industrial applications requiring precise chemical intermediates.
Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride structure
1305320-57-3 structure
Product Name:Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride
CAS No:1305320-57-3
MF:C8H13ClN2O2
MW:204.654021024704
MDL:MFCD16495875
CID:1056288
PubChem ID:53429624
Update Time:2025-05-21

Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride Chemical and Physical Properties

Names and Identifiers

    • Ethyl 3,5-Dimethylpyrazole-4-carboxylate Hydrochloride
    • Ethyl 3,5-dimethyl-1H-pyrazole-4-carboxylate hydrochloride (1:1)
    • ethyl 3,5-dimethyl-1H-pyrazole-4-carboxylate;hydrochloride
    • DB-020789
    • CS-0444231
    • EN300-133022
    • 1H-Pyrazole-4-carboxylic acid, 3,5-dimethyl-, ethyl ester, hydrochloride (1:1)
    • AKOS015950545
    • SY008010
    • AC3689
    • 1305320-57-3
    • ethyl 3,5-dimethyl-1H-pyrazole-4-carboxylate hydrochloride
    • ETHYL3,5-DIMETHYLPYRAZOLE-4-CARBOXYLATEHYDROCHLORIDE
    • Ethyl 3,5-dimethylpyrazole-4-carboxylate, HCl
    • MFCD16495875
    • A888726
    • Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride
    • MDL： MFCD16495875
    • Inchi： 1S/C8H12N2O2.ClH/c1-4-12-8(11)7-5(2)9-10-6(7)3;/h4H2,1-3H3,(H,9,10);1H
    • InChI Key： QZGZCHFHAGNIRG-UHFFFAOYSA-N
    • SMILES： Cl.O(CC)C(C1C(C)=NNC=1C)=O

Computed Properties

  • Exact Mass: 204.06700
  • Monoisotopic Mass: 204.0665554g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 172
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 55?2

Experimental Properties

  • PSA: 54.98000
  • LogP: 2.00520

Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride Security Information

Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride Customs Data

  • HS CODE：2933199090
  • Customs Data：

    China Customs Code:

    2933199090

    Overview:

    2933199090. Other structurally non fused pyrazole ring compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride Related Literature

Related Categories

Additional information on Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride

Comprehensive Overview of Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride (CAS No. 1305320-57-3)

Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride (CAS No. 1305320-57-3) is a specialized organic compound widely utilized in pharmaceutical and agrochemical research. This compound, belonging to the pyrazole family, has garnered significant attention due to its versatile applications in drug discovery and material science. Researchers and industries are increasingly exploring its potential as a building block for synthesizing novel bioactive molecules, aligning with the growing demand for high-performance intermediates in modern chemistry.

The molecular structure of Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride features a pyrazole core substituted with methyl groups at positions 3 and 5, along with an ethyl carboxylate moiety at position 4. This unique arrangement contributes to its reactivity and compatibility with various synthetic pathways. Recent studies highlight its role in developing heterocyclic compounds, a trending topic in medicinal chemistry, as these structures often exhibit enhanced bioavailability and target specificity.

In the context of green chemistry and sustainable synthesis, CAS 1305320-57-3 has been investigated for its efficiency in catalytic reactions. With the global shift toward eco-friendly processes, this compound’s potential to reduce waste and energy consumption aligns with industry priorities. Researchers are also examining its stability under different conditions, addressing common queries about storage recommendations and solubility profiles in polar solvents like ethanol and DMSO.

The compound’s relevance extends to crop protection and agrochemical innovation, where pyrazole derivatives are known for their herbicidal and fungicidal properties. As precision agriculture gains traction, Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride is being studied for its role in formulating next-generation plant growth regulators. This application resonates with current searches for sustainable farming solutions and non-toxic additives.

From a commercial perspective, suppliers of CAS 1305320-57-3 emphasize its high purity (>98%) and compliance with Good Manufacturing Practices (GMP). Analytical techniques such as HPLC and NMR spectroscopy are routinely employed to verify its quality, a critical factor for laboratories focusing on reproducible results. FAQs about its handling precautions often highlight standard laboratory safety measures, including the use of gloves and ventilation.

In summary, Ethyl 3,5-Dimethyl-1H-pyrazole-4-carboxylate Hydrochloride represents a multifaceted tool for researchers addressing challenges in drug design, sustainable chemistry, and agricultural science. Its structural adaptability and functional group diversity make it a valuable asset in both academic and industrial settings, reflecting broader trends toward innovation and efficiency in chemical sciences.

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