Cas no 1193389-16-0 (1-(4-fluorophenoxy)propan-2-amine hydrochloride)

1-(4-Fluorophenoxy)propan-2-amine hydrochloride is a fluorinated organic compound with potential applications in pharmaceutical and chemical research. Its structure features a phenoxy group substituted with a fluorine atom at the para position, coupled with an amine-functionalized propane backbone, rendered stable and water-soluble as a hydrochloride salt. This compound is valued for its versatility as a building block in medicinal chemistry, particularly in the synthesis of bioactive molecules targeting central nervous system (CNS) disorders or adrenergic pathways. The fluorine substitution enhances metabolic stability and binding affinity, while the hydrochloride form ensures improved handling and storage characteristics. Suitable for controlled reactions, it offers researchers a reliable intermediate for developing novel therapeutic agents.
1-(4-fluorophenoxy)propan-2-amine hydrochloride structure
1193389-16-0 structure
Product Name:1-(4-fluorophenoxy)propan-2-amine hydrochloride
CAS No:1193389-16-0
MF:C9H13ClFNO
MW:205.657025098801
MDL:MFCD06247711
CID:858508
PubChem ID:45791956
Update Time:2025-06-08

1-(4-fluorophenoxy)propan-2-amine hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 1-(4-Fluorophenoxy)-2-propanaMine HCl
    • 1-(4-fluorophenoxy)propan-2-amine hydrochloride
    • 1-(2-aminopropoxy)-4-fluorobenzene hydrochloride
    • CS-0453689
    • F1989-0016
    • 1-(4-fluorophenoxy)propan-2-amine;hydrochloride
    • EN300-52043
    • AKOS025296004
    • 1193389-16-0
    • C77796
    • MDL: MFCD06247711
    • Inchi: 1S/C9H12FNO.ClH/c1-7(11)6-12-9-4-2-8(10)3-5-9;/h2-5,7H,6,11H2,1H3;1H
    • InChI Key: DZFKSENVDGIYBA-UHFFFAOYSA-N
    • SMILES: Cl.FC1C=CC(=CC=1)OCC(C)N

Computed Properties

  • Exact Mass: 205.0669699g/mol
  • Monoisotopic Mass: 205.0669699g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 124
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 35.2?2

Experimental Properties

  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 255.5±20.0 °C at 760 mmHg
  • Flash Point: 108.3±21.8 °C
  • Vapor Pressure: 0.0±0.5 mmHg at 25°C

1-(4-fluorophenoxy)propan-2-amine hydrochloride Security Information

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Additional information on 1-(4-fluorophenoxy)propan-2-amine hydrochloride

Comprehensive Overview of 1-(4-fluorophenoxy)propan-2-amine hydrochloride (CAS No. 1193389-16-0)

1-(4-fluorophenoxy)propan-2-amine hydrochloride (CAS No. 1193389-16-0) is a specialized organic compound that has garnered significant attention in pharmaceutical and biochemical research. This compound, characterized by its fluorophenoxy moiety and amine hydrochloride functional group, is widely studied for its potential applications in drug development and molecular biology. Researchers are particularly interested in its structural properties, which make it a valuable intermediate in synthesizing more complex molecules.

The compound's CAS number 1193389-16-0 serves as a unique identifier, ensuring precise tracking in chemical databases and regulatory frameworks. Its systematic name, 1-(4-fluorophenoxy)propan-2-amine hydrochloride, reflects its molecular structure, combining a fluorinated aromatic ring with an amine hydrochloride salt. This combination enhances its solubility and stability, making it suitable for various experimental conditions. Recent studies highlight its role in modulating specific biochemical pathways, though further research is needed to fully elucidate its mechanisms.

In the context of current trends, 1-(4-fluorophenoxy)propan-2-amine hydrochloride aligns with the growing demand for fluorinated compounds in medicinal chemistry. Fluorination is a key strategy to improve drug bioavailability and metabolic stability, topics frequently searched in academic and industrial circles. The compound's amine hydrochloride component also ties into discussions about salt formation to optimize physicochemical properties, a hot topic in formulation science.

From a synthetic perspective, the preparation of CAS No. 1193389-16-0 involves multi-step organic reactions, often starting with 4-fluorophenol and proceeding through nucleophilic substitution and subsequent amination. Researchers emphasize the importance of purity and yield in these processes, as impurities can significantly impact downstream applications. Analytical techniques such as HPLC, NMR, and mass spectrometry are routinely employed to characterize the compound, ensuring compliance with industry standards.

The versatility of 1-(4-fluorophenoxy)propan-2-amine hydrochloride extends to its potential use in central nervous system (CNS) drug discovery, a field experiencing rapid growth due to increasing neurological disorders. Its structural similarity to known bioactive molecules has prompted investigations into its receptor binding affinity and pharmacokinetic profile. These studies are often linked to broader searches for novel therapeutic agents and drug repurposing strategies.

Environmental and safety considerations are also critical when working with CAS No. 1193389-16-0. While not classified as hazardous under standard guidelines, proper handling protocols are essential to minimize risks. This aligns with the broader scientific community's focus on green chemistry and sustainable synthesis, topics frequently explored in contemporary literature.

In summary, 1-(4-fluorophenoxy)propan-2-amine hydrochloride (CAS No. 1193389-16-0) represents a promising compound with diverse applications in research and development. Its unique chemical properties, coupled with ongoing advancements in fluorinated drug design, position it as a subject of continued interest. As the scientific community delves deeper into its potential, this compound may pave the way for innovative solutions in healthcare and beyond.

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