Cas no 170843-43-3 (Ethyl 3-methylpiperidine-3-carboxylate)

Ethyl 3-methylpiperidine-3-carboxylate is a versatile heterocyclic compound featuring a piperidine core substituted with a methyl group and an ethyl ester at the 3-position. This structure imparts significant utility in pharmaceutical and agrochemical synthesis, serving as a key intermediate for the development of bioactive molecules. Its ester functionality allows for further derivatization, while the methyl substitution enhances steric and electronic properties, enabling tailored reactivity. The compound exhibits good stability under standard conditions, facilitating handling and storage. Its balanced lipophilicity and synthetic flexibility make it valuable for medicinal chemistry applications, particularly in the design of alkaloid-based therapeutics or fine chemical precursors.
Ethyl 3-methylpiperidine-3-carboxylate structure
170843-43-3 structure
Product Name:Ethyl 3-methylpiperidine-3-carboxylate
CAS No:170843-43-3
MF:C9H17NO2
MW:171.23678278923
MDL:MFCD09029850
CID:65874
PubChem ID:18419721
Update Time:2025-06-13

Ethyl 3-methylpiperidine-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 3-methylpiperidine-3-carboxylate
    • 3-Methyl-3-piperidinecarboxylic acid ethyl ester
    • ethyl 3-methylpiperidine-3-carboxylate hydrochloride
    • (+-) Ethyl 3-Methylpiperidine-3-carboxylate
    • 3-Methyl-piperidine-3-carboxylic acid
    • 3-methylpiperidine-3-carboxylic acid ethyl ester
    • ethyl 3-methyl-3-piperidinecarboxylate
    • Ethyl 4-Methylpiperidine-3-carboxylate
    • 3-Piperidinecarboxylic acid, 3-methyl-, ethyl ester
    • 3-Methyl-piperidine-3-carboxylic acid ethyl ester
    • FT-0648829
    • AC-6364
    • DTXSID50593598
    • A26601
    • SCHEMBL567321
    • AKOS012435914
    • J-520890
    • 170843-43-3
    • Ethyl-3-methyl-3-piperidinecarboxylate
    • SB22006
    • F98435
    • Ethyl3-methylpiperidine-3-carboxylate
    • EN300-5242055
    • CS-0298799
    • LNANFKKPVLUIBX-UHFFFAOYSA-N
    • DB-064792
    • 3-Methyl-3-piperidinecarboxylicacidethylester
    • MDL: MFCD09029850
    • Inchi: 1S/C9H17NO2/c1-3-12-8(11)9(2)5-4-6-10-7-9/h10H,3-7H2,1-2H3
    • InChI Key: LNANFKKPVLUIBX-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1(C)CNCCC1)=O

Computed Properties

  • Exact Mass: 171.12600
  • Monoisotopic Mass: 171.126
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 170
  • 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
  • Topological Polar Surface Area: 38.3A^2
  • XLogP3: 0.9

Experimental Properties

  • Density: 0.978
  • Boiling Point: 221 oC
  • Flash Point: 87 oC
  • Refractive Index: 1.445
  • PSA: 38.33000
  • LogP: 1.26800

Ethyl 3-methylpiperidine-3-carboxylate Customs Data

  • HS CODE:2933399090
  • Customs Data:

    China Customs Code:

    2933399090

    Overview:

    2933399090. Other compounds with non fused pyridine rings in structure. 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:

    2933399090. other compounds containing an unfused pyridine 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-methylpiperidine-3-carboxylate Suppliers

Amadis Chemical Company Limited
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(CAS:170843-43-3)Ethyl 3-methylpiperidine-3-carboxylate
Order Number:A26601
Stock Status:in Stock
Quantity:25g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 16:03
Price ($):1088.0

Ethyl 3-methylpiperidine-3-carboxylate Related Literature

Additional information on Ethyl 3-methylpiperidine-3-carboxylate

Ethyl 3-methylpiperidine-3-carboxylate (CAS No. 170843-43-3): A Comprehensive Overview in Modern Chemical Research

Ethyl 3-methylpiperidine-3-carboxylate (CAS No. 170843-43-3) is a significant compound in the realm of chemical biology and pharmaceutical research. This compound, characterized by its unique structural and functional properties, has garnered considerable attention due to its potential applications in drug development and synthetic chemistry. The piperidine ring, a key structural motif, contributes to the molecule's versatility, making it a valuable intermediate in the synthesis of more complex organic molecules.

The compound's molecular structure, featuring a carboxylate ester group and a methyl-substituted piperidine ring, positions it as a versatile building block for medicinal chemists. The ester functionality not only influences the compound's solubility and reactivity but also opens up possibilities for further derivatization, enabling the creation of novel derivatives with tailored biological activities. This adaptability has made Ethyl 3-methylpiperidine-3-carboxylate a subject of interest in various research avenues.

In recent years, the pharmaceutical industry has seen a surge in the exploration of piperidine derivatives due to their favorable pharmacokinetic properties and potential therapeutic benefits. Ethyl 3-methylpiperidine-3-carboxylate, with its well-defined structure, has been investigated for its role in developing new drugs targeting neurological disorders, cardiovascular diseases, and infectious diseases. Its ability to serve as a precursor for more complex molecules has been particularly valuable in these endeavors.

One of the most compelling aspects of Ethyl 3-methylpiperidine-3-carboxylate is its utility in the synthesis of bioactive molecules. The presence of both the carboxylate ester and the methyl-substituted piperidine ring allows for diverse chemical modifications, enabling researchers to fine-tune the compound's properties for specific applications. This flexibility has been exploited in several studies aimed at developing novel therapeutic agents.

Recent advancements in computational chemistry have further highlighted the importance of Ethyl 3-methylpiperidine-3-carboxylate in drug discovery. Molecular modeling studies have demonstrated its potential as a scaffold for small-molecule drugs, providing insights into how it can interact with biological targets. These studies have not only enhanced our understanding of the compound's mechanism of action but also paved the way for more efficient drug design strategies.

The synthesis of Ethyl 3-methylpiperidine-3-carboxylate involves multi-step organic reactions that showcase the compound's synthetic utility. The process typically begins with the preparation of 3-methylpiperidine-3-carboxylic acid, which is then esterified to yield the ethyl derivative. This synthetic route highlights the compound's role as an intermediate in organic synthesis and underscores its importance in pharmaceutical manufacturing.

From a biological perspective, Ethyl 3-methylpiperidine-3-carboxylate has shown promise in preclinical studies as a potential therapeutic agent. Its structural features suggest interactions with various biological targets, making it a candidate for further investigation in drug development pipelines. The compound's ability to modulate biological pathways has been explored in models of neurological disorders, where it has demonstrated potential benefits.

The growing interest in Ethyl 3-methylpiperidine-3-carboxylate is also reflected in its increasing presence in scientific literature. Researchers worldwide are investigating its applications across different fields, from medicinal chemistry to materials science. This widespread interest underscores the compound's significance and highlights its potential to contribute to advancements in multiple domains.

In conclusion, Ethyl 3-methylpiperidine-3-carboxylate (CAS No. 170843-43-3) is a multifaceted compound with significant implications in chemical biology and pharmaceutical research. Its unique structural features and versatile reactivity make it a valuable tool for drug development and synthetic chemistry. As research continues to uncover new applications for this compound, its importance is likely to grow even further, solidifying its place as a key player in modern chemical research.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:170843-43-3)Ethyl 3-methylpiperidine-3-carboxylate
A26601
Purity:99%
Quantity:25g
Price ($):1088.0
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