Cas no 1250409-48-3 (1-(2,4-difluorophenyl)-3-methoxypropan-2-amine)

1-(2,4-Difluorophenyl)-3-methoxypropan-2-amine is a fluorinated aromatic amine derivative with potential applications in pharmaceutical and agrochemical research. Its structure features a difluorophenyl group, which enhances metabolic stability and bioavailability, alongside a methoxypropylamine moiety that contributes to its reactivity and solubility profile. This compound is particularly valuable as an intermediate in the synthesis of biologically active molecules, including CNS-targeting agents and antifungal compounds. The presence of fluorine atoms improves lipophilicity and binding affinity, while the methoxy group offers synthetic versatility for further functionalization. Suitable for controlled reactions, it is typically handled under inert conditions to preserve stability. Available in high purity, it is ideal for exploratory medicinal chemistry and structure-activity relationship studies.
1-(2,4-difluorophenyl)-3-methoxypropan-2-amine structure
1250409-48-3 structure
Product Name:1-(2,4-difluorophenyl)-3-methoxypropan-2-amine
CAS No:1250409-48-3
MF:C10H13F2NO
MW:201.213129758835
CID:5969442
PubChem ID:62196901
Update Time:2025-10-29

1-(2,4-difluorophenyl)-3-methoxypropan-2-amine Chemical and Physical Properties

Names and Identifiers

    • Benzeneethanamine, 2,4-difluoro-α-(methoxymethyl)-
    • 1-(2,4-Difluorophenyl)-3-methoxypropan-2-amine
    • EN300-2111546
    • CS-0239369
    • AKOS011477985
    • 1250409-48-3
    • 1-(2,4-difluorophenyl)-3-methoxypropan-2-amine
    • Inchi: 1S/C10H13F2NO/c1-14-6-9(13)4-7-2-3-8(11)5-10(7)12/h2-3,5,9H,4,6,13H2,1H3
    • InChI Key: BAKPKQVHOYVXNI-UHFFFAOYSA-N
    • SMILES: C(C1C=CC(F)=CC=1F)C(N)COC

Computed Properties

  • Exact Mass: 201.09652036g/mol
  • Monoisotopic Mass: 201.09652036g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 168
  • 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
  • XLogP3: 1.4
  • Topological Polar Surface Area: 35.2?2

Experimental Properties

  • Density: 1.155±0.06 g/cm3(Predicted)
  • Boiling Point: 272.9±40.0 °C(Predicted)
  • pka: 7.61±0.10(Predicted)

1-(2,4-difluorophenyl)-3-methoxypropan-2-amine Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-2111546-1g
1-(2,4-difluorophenyl)-3-methoxypropan-2-amine
1250409-48-3 95%
1g
$914.0 2023-09-16
Enamine
EN300-2111546-5g
1-(2,4-difluorophenyl)-3-methoxypropan-2-amine
1250409-48-3 95%
5g
$2650.0 2023-09-16
Enamine
EN300-2111546-10g
1-(2,4-difluorophenyl)-3-methoxypropan-2-amine
1250409-48-3 95%
10g
$3929.0 2023-09-16
Enamine
EN300-2111546-0.05g
1-(2,4-difluorophenyl)-3-methoxypropan-2-amine
1250409-48-3 95%
0.05g
$212.0 2023-09-16
Enamine
EN300-2111546-0.1g
1-(2,4-difluorophenyl)-3-methoxypropan-2-amine
1250409-48-3 95%
0.1g
$317.0 2023-09-16
Enamine
EN300-2111546-0.25g
1-(2,4-difluorophenyl)-3-methoxypropan-2-amine
1250409-48-3 95%
0.25g
$452.0 2023-09-16
Enamine
EN300-2111546-0.5g
1-(2,4-difluorophenyl)-3-methoxypropan-2-amine
1250409-48-3 95%
0.5g
$713.0 2023-09-16
Enamine
EN300-2111546-1.0g
1-(2,4-difluorophenyl)-3-methoxypropan-2-amine
1250409-48-3 95%
1g
$914.0 2023-05-31
Enamine
EN300-2111546-2.5g
1-(2,4-difluorophenyl)-3-methoxypropan-2-amine
1250409-48-3 95%
2.5g
$1791.0 2023-09-16
Enamine
EN300-2111546-5.0g
1-(2,4-difluorophenyl)-3-methoxypropan-2-amine
1250409-48-3 95%
5g
$2650.0 2023-05-31

Additional information on 1-(2,4-difluorophenyl)-3-methoxypropan-2-amine

Professional Introduction to Compound with CAS No. 1250409-48-3 and Product Name: 1-(2,4-difluorophenyl)-3-methoxypropan-2-amine

The compound with the CAS number 1250409-48-3 and the product name 1-(2,4-difluorophenyl)-3-methoxypropan-2-amine represents a significant advancement in the field of pharmaceutical chemistry. This compound, characterized by its unique structural features, has garnered considerable attention due to its potential applications in medicinal chemistry and drug development. The molecular structure incorporates both 2,4-difluorophenyl and methoxypropan-2-amine moieties, which contribute to its distinct chemical properties and biological activities.

In recent years, the pharmaceutical industry has witnessed a surge in the exploration of fluorinated aromatic compounds due to their enhanced metabolic stability, improved binding affinity, and increased bioavailability. The presence of fluoro substituents in the 2,4-difluorophenyl group is particularly noteworthy, as fluorine atoms can significantly influence the electronic and steric properties of a molecule. This modification often leads to more potent and selective pharmacological effects, making such compounds highly valuable in drug discovery.

The methoxypropan-2-amine moiety in the compound adds another layer of complexity, contributing to its versatility in chemical modifications. This group is commonly employed in the synthesis of various bioactive molecules due to its ability to participate in hydrogen bonding interactions and its role as a pharmacophore in many drug candidates. The combination of these structural elements makes 1-(2,4-difluorophenyl)-3-methoxypropan-2-amine a promising candidate for further investigation.

Recent studies have highlighted the importance of fluorinated aromatic compounds in the development of novel therapeutics. For instance, research published in leading journals such as *Journal of Medicinal Chemistry* and *Bioorganic & Medicinal Chemistry* has demonstrated that compounds containing difluorophenyl groups exhibit significant activity against various biological targets. These studies have shown that the introduction of fluorine atoms can modulate the pharmacokinetic profile of drugs, leading to improved efficacy and reduced side effects.

The methoxypropan-2-amine component has also been extensively studied for its role in enhancing drug-like properties. This group is frequently found in active pharmaceutical ingredients (APIs) due to its ability to improve solubility, reduce lipophilicity, and enhance metabolic stability. The synergistic effect of combining these structural features in 1-(2,4-difluorophenyl)-3-methoxypropan-2-amine suggests that it may possess unique pharmacological characteristics that could be exploited for therapeutic applications.

In the context of drug discovery, the synthesis and characterization of this compound are critical steps toward understanding its potential as a lead molecule. Advanced synthetic methodologies have been employed to construct the target molecule with high precision, ensuring that all structural features are accurately represented. Techniques such as NMR spectroscopy, mass spectrometry, and X-ray crystallography have been utilized to confirm the identity and purity of the compound.

Furthermore, computational studies have played a pivotal role in predicting the biological activity of 1-(2,4-difluorophenyl)-3-methoxypropan-2-amine. Molecular docking simulations have been used to evaluate how this compound interacts with various biological targets, providing insights into its potential mechanism of action. These simulations have helped researchers identify key binding pockets and optimize the structure for improved activity.

The potential applications of this compound extend across multiple therapeutic areas. For example, preliminary studies suggest that it may exhibit inhibitory activity against enzymes involved in inflammatory pathways. Given the growing interest in developing anti-inflammatory drugs with improved efficacy and safety profiles, this compound could represent a valuable addition to ongoing research efforts.

Additionally, the structural motifs present in 1-(2,4-difluorophenyl)-3-methoxypropan-2-amine are reminiscent of known pharmacophores found in successful drugs used to treat neurological disorders. The combination of fluoro substituents and amine functionalities has been associated with enhanced penetration across the blood-brain barrier, making this compound a candidate for further exploration in neuropharmacology.

The synthesis of derivatives based on this core structure represents another avenue for expanding its therapeutic potential. By modifying either the 2,4-difluorophenyl or methoxypropan-2-amine moieties, researchers can generate a library of compounds with varying biological activities. High-throughput screening (HTS) techniques can then be employed to identify analogs with enhanced potency or selectivity against specific targets.

In conclusion, 1-(2,4-difluorophenyl)-3-methoxypropan-2-amine (CAS No. 1250409-48-3) is a structurally interesting compound with significant potential in pharmaceutical research. Its unique combination of fluoro substituents, amine functionalities, and other key structural elements makes it a promising candidate for further investigation. As research continues to uncover new applications for fluorinated aromatic compounds, this molecule is poised to play a crucial role in the development of novel therapeutics across multiple therapeutic areas.

Recommended suppliers
Hunan Well Medicine Synthesis Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hunan Well Medicine Synthesis Technology Co., Ltd.
ASIACHEM I&E (JIANGSU) CO., LTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
ASIACHEM I&E (JIANGSU) CO., LTD
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Beyond Pharmaceutical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hebei Liye chemical Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Hebei Liye chemical Co.,Ltd