Cas no 404010-84-0 (Methyl 2-amino-4-morpholinobenzoate)

Methyl 2-amino-4-morpholinobenzoate is a benzoate derivative featuring both morpholine and amino functional groups, making it a versatile intermediate in organic synthesis and pharmaceutical applications. Its structural properties enable selective reactivity, particularly in the development of heterocyclic compounds and active pharmaceutical ingredients (APIs). The morpholine moiety enhances solubility and bioavailability, while the ester group allows for further functionalization. This compound is valued for its stability under standard conditions and compatibility with a range of reaction conditions, including nucleophilic substitutions and catalytic transformations. Its well-defined molecular structure ensures consistent performance in research and industrial processes.
Methyl 2-amino-4-morpholinobenzoate structure
404010-84-0 structure
Product Name:Methyl 2-amino-4-morpholinobenzoate
CAS No:404010-84-0
MF:C12H16N2O3
MW:236.267043113708
MDL:MFCD22192343
CID:1057053
Update Time:2025-06-15

Methyl 2-amino-4-morpholinobenzoate Chemical and Physical Properties

Names and Identifiers

    • Methyl 2-amino-4-morpholinobenzoate
    • Methyl 2-amino-4-(4-morpholinyl)benzoate
    • Benzoic acid, 2-amino-4-(4-morpholinyl)-, methyl ester
    • methyl 2-amino-4-morpholin-4-ylbenzoate
    • XQTXHIWXBHFMRZ-UHFFFAOYSA-N
    • Methyl2-Amino-4-morpholinobenzoate
    • 6945AJ
    • TRA0015324
    • SY019138
    • AX8268484
    • MDL: MFCD22192343
    • Inchi: 1S/C12H16N2O3/c1-16-12(15)10-3-2-9(8-11(10)13)14-4-6-17-7-5-14/h2-3,8H,4-7,13H2,1H3
    • InChI Key: XQTXHIWXBHFMRZ-UHFFFAOYSA-N
    • SMILES: O1CCN(C2C=CC(C(=O)OC)=C(C=2)N)CC1

Computed Properties

  • Exact Mass: 236.11618
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 267
  • XLogP3: 2.4
  • Topological Polar Surface Area: 64.8

Experimental Properties

  • PSA: 64.79

Methyl 2-amino-4-morpholinobenzoate Pricemore >>

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Methyl 2-amino-4-morpholinobenzoate Suppliers

Amadis Chemical Company Limited
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(CAS:404010-84-0)Methyl 2-amino-4-morpholinobenzoate
Order Number:A873353
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 09:39
Price ($):369.0

Additional information on Methyl 2-amino-4-morpholinobenzoate

Methyl 2-amino-4-morpholinobenzoate (CAS No. 404010-84-0): A Comprehensive Overview

Methyl 2-amino-4-morpholinobenzoate (CAS No. 404010-84-0) is a specialized organic compound that has garnered significant attention in the field of pharmaceutical research and chemical synthesis. This compound, characterized by its unique structural features, exhibits promising properties that make it a valuable candidate for various applications, particularly in the development of novel therapeutic agents. The integration of morpholine and amino functional groups within its molecular framework imparts distinct chemical and biological characteristics, which are leveraged in contemporary research.

The molecular structure of Methyl 2-amino-4-morpholinobenzoate consists of a benzoic acid backbone substituted with an amino group at the 2-position and a morpholine ring at the 4-position. This arrangement not only contributes to its stability but also enhances its reactivity, making it a versatile intermediate in synthetic chemistry. The presence of the morpholine moiety is particularly noteworthy, as it is known for its ability to form stable complexes with various biomolecules, thereby influencing drug-target interactions.

In recent years, there has been a surge in research focused on developing small molecules with enhanced bioavailability and targeted action. Methyl 2-amino-4-morpholinobenzoate has emerged as a compound of interest due to its potential to modulate biological pathways associated with inflammation, neurodegeneration, and cancer. Its dual functionality allows for selective interactions with enzymes and receptors, which is crucial for designing drugs with minimal side effects.

One of the most compelling aspects of Methyl 2-amino-4-morpholinobenzoate is its role as a precursor in the synthesis of more complex pharmacophores. Researchers have utilized this compound to develop derivatives that exhibit improved pharmacokinetic profiles and enhanced therapeutic efficacy. For instance, studies have shown that modifications at the amino and morpholine positions can significantly alter the compound's solubility, metabolic stability, and binding affinity to biological targets.

The pharmacological potential of Methyl 2-amino-4-morpholinobenzoate has been explored in several preclinical studies. These investigations have highlighted its ability to inhibit key enzymes involved in inflammatory responses, such as cyclooxygenase (COX) and lipoxygenase (LOX). Additionally, preliminary data suggest that this compound may have neuroprotective properties, making it a promising candidate for treating neurodegenerative disorders like Alzheimer's and Parkinson's disease.

The synthesis of Methyl 2-amino-4-morpholinobenzoate involves multi-step organic reactions that require precise control over reaction conditions to ensure high yield and purity. Advanced synthetic methodologies, including palladium-catalyzed cross-coupling reactions and enzymatic transformations, have been employed to optimize the production process. These techniques not only improve efficiency but also minimize waste generation, aligning with the principles of green chemistry.

The analytical characterization of Methyl 2-amino-4-morpholinobenzoate has been conducted using state-of-the-art spectroscopic techniques such as nuclear magnetic resonance (NMR) spectroscopy, mass spectrometry (MS), and high-performance liquid chromatography (HPLC). These methods provide detailed insights into the compound's structure and purity, ensuring that it meets the stringent requirements for pharmaceutical applications.

In conclusion, Methyl 2-amino-4-morpholinobenzoate (CAS No. 404010-84-0) represents a significant advancement in the field of medicinal chemistry. Its unique structural attributes and promising biological activities position it as a valuable tool for drug discovery and development. As research continues to uncover new applications for this compound, it is expected to play an increasingly important role in addressing some of the most challenging medical conditions facing society today.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:404010-84-0)Methyl 2-amino-4-morpholinobenzoate
A873353
Purity:99%
Quantity:5g
Price ($):369.0
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