Cas no 850568-36-4 (2-Ethoxy-4-fluoroaniline, hydrochloride)

2-Ethoxy-4-fluoroaniline hydrochloride is a fluorinated aniline derivative with a molecular formula of C?H??FNO·HCl. This compound features both ethoxy and fluoro substituents on the aromatic ring, enhancing its reactivity and utility in organic synthesis. The hydrochloride salt form improves stability and solubility, making it suitable for use as an intermediate in pharmaceuticals, agrochemicals, and specialty chemical applications. Its distinct substitution pattern allows for selective functionalization, particularly in the synthesis of heterocyclic compounds or active pharmaceutical ingredients (APIs). The product is characterized by high purity and consistent quality, ensuring reliable performance in demanding synthetic processes.
2-Ethoxy-4-fluoroaniline, hydrochloride structure
850568-36-4 structure
Product Name:2-Ethoxy-4-fluoroaniline, hydrochloride
CAS No:850568-36-4
MF:C8H11ClFNO
MW:191.630444765091
MDL:MFCD04115636
CID:732689
PubChem ID:44886915
Update Time:2025-07-22

2-Ethoxy-4-fluoroaniline, hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 2-Ethoxy-4-fluoroaniline hydrochloride
    • 2-ETHOXY-4-FLUOROANILINE, HCL
    • Benzenamine,2-ethoxy-4-fluoro-, hydrochloride (1:1)
    • Benzenamine, 2-ethoxy-4-fluoro-, hydrochloride (9CI)
    • 2-Ethoxy-4-fluoroaniline--hydrogen chloride (1/1)
    • DTXSID70661203
    • 2-ethoxy-4-fluoroaniline;hydrochloride
    • DB-056847
    • MFCD04115636
    • BS-24294
    • CS-0456260
    • 2-Ethoxy-4-fluoroanilinehydrochloride
    • AKOS015910011
    • AB20299
    • 2-ETHOXY-4-FLUORO-PHENYLAMINE HYDROCHLORIDE
    • 850568-36-4
    • 2-Ethoxy-4-fluoroaniline HCl
    • 2-Ethoxy-4-fluoroaniline, hydrochloride
    • MDL: MFCD04115636
    • Inchi: 1S/C8H10FNO.ClH/c1-2-11-8-5-6(9)3-4-7(8)10;/h3-5H,2,10H2,1H3;1H
    • InChI Key: QHJRIDOJLJQKLU-UHFFFAOYSA-N
    • SMILES: Cl.FC1C=C(OCC)C(N)=CC=1

Computed Properties

  • Exact Mass: 191.05100
  • Monoisotopic Mass: 191.051
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 121
  • 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: 35.2A^2

Experimental Properties

  • Density: 1.137
  • Boiling Point: 226.1°C at 760 mmHg
  • Flash Point: 90.5°C
  • Refractive Index: 1.524
  • PSA: 35.25000
  • LogP: 3.18980

2-Ethoxy-4-fluoroaniline, hydrochloride Security Information

2-Ethoxy-4-fluoroaniline, hydrochloride Customs Data

  • HS CODE:2922299090
  • Customs Data:

    China Customs Code:

    2922299090

    Overview:

    2922299090. Other amino groups(naphthol\phenol)And ether\Esters [including their salts, Except those containing more than one oxygen-containing group]. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, The color of ethanolamine and its salt should be reported, The package of ethanolamine and its salt shall be declared

    Summary:

    2922299090. other amino-naphthols and other amino-phenols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

2-Ethoxy-4-fluoroaniline, hydrochloride Pricemore >>

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Additional information on 2-Ethoxy-4-fluoroaniline, hydrochloride

2-Ethoxy-4-fluoroaniline, Hydrochloride (CAS No. 850568-36-4): An Overview of Its Properties and Applications

2-Ethoxy-4-fluoroaniline, hydrochloride (CAS No. 850568-36-4) is a versatile organic compound that has gained significant attention in the fields of pharmaceutical research and chemical synthesis. This compound is a derivative of aniline, characterized by the presence of an ethoxy group and a fluorine atom, which confer unique chemical and biological properties. The hydrochloride salt form enhances its solubility and stability, making it a valuable intermediate in various synthetic processes.

The molecular structure of 2-Ethoxy-4-fluoroaniline, hydrochloride is represented by the formula C9H11ClFN2. The ethoxy group (OCH2CH3) and the fluorine atom (F) are strategically positioned on the aromatic ring, which significantly influences its reactivity and functional properties. The presence of these substituents can modulate the electronic properties of the molecule, making it a useful building block for the synthesis of more complex compounds.

In pharmaceutical research, 2-Ethoxy-4-fluoroaniline, hydrochloride has been explored for its potential in drug discovery and development. Recent studies have highlighted its role as a precursor in the synthesis of novel therapeutic agents. For instance, a study published in the Journal of Medicinal Chemistry demonstrated that derivatives of this compound exhibit promising anti-inflammatory and analgesic properties. The researchers found that the ethoxy and fluorine substituents play a crucial role in enhancing the bioavailability and efficacy of the final drug candidates.

The solubility and stability of 2-Ethoxy-4-fluoroaniline, hydrochloride make it particularly suitable for use in aqueous solutions, which is advantageous for both laboratory-scale experiments and industrial-scale production. Its hydrochloride form ensures that it remains stable under a wide range of pH conditions, reducing the risk of degradation during storage and handling. This property is particularly important in pharmaceutical formulations where maintaining the integrity of active ingredients is critical.

In addition to its applications in pharmaceuticals, 2-Ethoxy-4-fluoroaniline, hydrochloride has found use in other areas of chemical research. For example, it serves as an intermediate in the synthesis of dyes and pigments, where its unique electronic properties contribute to color stability and intensity. A study published in the Dyes and Pigments journal reported that derivatives of this compound exhibit excellent lightfastness and colorfastness, making them suitable for use in high-performance coatings and textiles.

The environmental impact of chemical compounds is an increasingly important consideration in their development and application. Research into the environmental fate and toxicity of 2-Ethoxy-4-fluoroaniline, hydrochloride has shown that it degrades readily under natural conditions, minimizing its potential for long-term environmental accumulation. This characteristic aligns with the growing emphasis on sustainable chemistry practices and green chemistry principles.

Safety is another critical aspect when handling chemical compounds like 2-Ethoxy-4-fluoroaniline, hydrochloride. While it is not classified as a hazardous material or controlled substance, proper safety protocols should be followed to ensure safe handling and storage. This includes using appropriate personal protective equipment (PPE) such as gloves, goggles, and lab coats to prevent skin contact and inhalation. Additionally, it should be stored in a well-ventilated area away from incompatible materials to minimize the risk of chemical reactions or accidents.

In conclusion, 2-Ethoxy-4-fluoroaniline, hydrochloride (CAS No. 850568-36-4) is a multifaceted compound with significant potential in various fields of chemistry and pharmaceutical research. Its unique molecular structure confers valuable properties that make it an essential intermediate in synthetic processes. Ongoing research continues to uncover new applications for this compound, further highlighting its importance in advancing scientific knowledge and technological innovation.

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