Cas no 195136-65-3 (5-Fluoro-2,4-dimethoxyaniline)
5-Fluoro-2,4-dimethoxyaniline Chemical and Physical Properties
Names and Identifiers
-
- 5-Fluoro-2,4-dimethoxyaniline
- 2,4-Dimethoxy-5-fluoroaniline
- 5-fluoro-2,4-dimethoxybenzenamine
- 1-Amino-2,4-dimethoxy-5-fluorobenzene
- 5-Fluoro-2,4-dimethoxy-phenylamine
- AC1Q4926
- AG-L-22441
- CTK4E1697
- SureCN6371301
- 4-AMINO-4-(4-FLUOROPHENYL)CYCLOHEXANOL
- STL555327
- Benzenamine, 5-fluoro-2,4-dimethoxy-
- DB-332988
- EN300-89875
- BBL101531
- 5-Fluoro-2,4-dimethoxy-phenylamine;5-FLUORO-2,4-DIMETHOXYANILINE
- A848676
- BP-13412
- MFCD12547861
- DTXSID00444288
- 195136-65-3
- QOIDQMOZTRAYET-UHFFFAOYSA-N
- VHA13665
- SCHEMBL6371301
- PS-8688
- CS-0172561
- AKOS005259370
-
- MDL: MFCD12547861
- Inchi: 1S/C8H10FNO2/c1-11-7-4-8(12-2)6(10)3-5(7)9/h3-4H,10H2,1-2H3
- InChI Key: QOIDQMOZTRAYET-UHFFFAOYSA-N
- SMILES: FC1=CC(=C(C=C1OC)OC)N
Computed Properties
- Exact Mass: 171.0696
- Monoisotopic Mass: 171.06955672g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 145
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.3
- Topological Polar Surface Area: 44.5?2
Experimental Properties
- Color/Form: Yellow to Brown Solid
- PSA: 44.48
5-Fluoro-2,4-dimethoxyaniline Security Information
- Signal Word:Warning
- Hazard Statement: H302
- Warning Statement: P264;P270;P301+P312;P330;P501
- Hazard Category Code: 22
-
Hazardous Material Identification:
- HazardClass:CORROSIVE
- Storage Condition:Room temperature
5-Fluoro-2,4-dimethoxyaniline Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | B434998-50mg |
5-Fluoro-2,4-dimethoxyaniline |
195136-65-3 | 50mg |
$ 50.00 | 2022-06-07 | ||
| TRC | B434998-100mg |
5-Fluoro-2,4-dimethoxyaniline |
195136-65-3 | 100mg |
$ 65.00 | 2022-06-07 | ||
| TRC | B434998-500mg |
5-Fluoro-2,4-dimethoxyaniline |
195136-65-3 | 500mg |
$ 115.00 | 2022-06-07 | ||
| Fluorochem | 038783-1g |
5-Fluoro-2,4-dimethoxyaniline |
195136-65-3 | 95% | 1g |
£120.00 | 2022-03-01 | |
| Fluorochem | 038783-5g |
5-Fluoro-2,4-dimethoxyaniline |
195136-65-3 | 95% | 5g |
£357.00 | 2022-03-01 | |
| Fluorochem | 038783-25g |
5-Fluoro-2,4-dimethoxyaniline |
195136-65-3 | 95% | 25g |
£1069.00 | 2022-03-01 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 059610-1g |
2,4-Dimethoxy-5-fluoroaniline |
195136-65-3 | 95% | 1g |
4193CNY | 2021-05-07 | |
| abcr | AB306109-1 g |
5-Fluoro-2,4-dimethoxyaniline; 97% |
195136-65-3 | 1g |
€220.60 | 2023-04-26 | ||
| abcr | AB306109-5 g |
5-Fluoro-2,4-dimethoxyaniline; 97% |
195136-65-3 | 5g |
€556.20 | 2023-04-26 | ||
| Apollo Scientific | PC7349-250mg |
2,4-Dimethoxy-5-fluoroaniline |
195136-65-3 | 250mg |
£26.00 | 2025-02-21 |
5-Fluoro-2,4-dimethoxyaniline Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
Additional information on 5-Fluoro-2,4-dimethoxyaniline
Introduction to 5-Fluoro-2,4-dimethoxyaniline (CAS No. 195136-65-3)
5-Fluoro-2,4-dimethoxyaniline, identified by the Chemical Abstracts Service Number (CAS No.) 195136-65-3, is a significant intermediate in the field of organic synthesis and pharmaceutical chemistry. This compound belongs to the class of aromatic amines, characterized by its fluorine and methoxy substituents on a benzene ring. The presence of these functional groups imparts unique chemical properties that make it valuable in various synthetic applications, particularly in the development of biologically active molecules.
The structure of 5-Fluoro-2,4-dimethoxyaniline consists of a benzene core with fluorine atoms at the 5-position and methoxy groups at the 2- and 4-positions. This arrangement creates a molecule with distinct electronic and steric properties, which are highly influential in its reactivity and potential applications. The fluorine atom, being electronegative, can participate in various interactions with other molecules, including hydrogen bonding and dipole-dipole interactions. Meanwhile, the methoxy groups contribute to the molecule's solubility in polar solvents and can serve as sites for further functionalization.
In recent years, 5-Fluoro-2,4-dimethoxyaniline has garnered attention in the pharmaceutical industry due to its role as a precursor in the synthesis of active pharmaceutical ingredients (APIs). Its structural features make it a versatile building block for constructing more complex molecules with therapeutic potential. For instance, derivatives of this compound have been explored in the development of drugs targeting neurological disorders, where the fluorine atom's ability to enhance metabolic stability is particularly advantageous.
One of the most compelling aspects of 5-Fluoro-2,4-dimethoxyaniline is its utility in medicinal chemistry. Researchers have leveraged its scaffold to design molecules with improved pharmacokinetic profiles. The fluorine substituent is known to increase binding affinity and reduce metabolic degradation, making it a preferred choice for drug designers aiming to enhance drug efficacy. Furthermore, the methoxy groups provide opportunities for further chemical modifications, allowing chemists to tailor the properties of the final product to specific biological targets.
Recent studies have highlighted the role of 5-Fluoro-2,4-dimethoxyaniline in the synthesis of kinase inhibitors, which are critical in treating cancers and inflammatory diseases. The ability of this compound to act as a hinge binder in protein-ligand interactions has been demonstrated through computational modeling and experimental validation. By occupying key binding pockets on target proteins, derivatives of 5-Fluoro-2,4-dimethoxyaniline can modulate enzyme activity and exert therapeutic effects.
The chemical synthesis of 5-Fluoro-2,4-dimethoxyaniline involves multi-step processes that require careful optimization to ensure high yield and purity. Common synthetic routes include nucleophilic aromatic substitution reactions followed by methylation and fluorination steps. Advanced techniques such as transition metal-catalyzed cross-coupling reactions have also been employed to improve efficiency and selectivity. These synthetic strategies underscore the compound's importance as a synthetic intermediate in industrial-scale production.
In addition to its pharmaceutical applications, 5-Fluoro-2,4-dimethoxyaniline has found utility in materials science. Its aromatic structure and functional groups make it a suitable candidate for developing organic semiconductors and liquid crystals. These materials are essential components in electronic devices such as displays and sensors, where their electronic properties play a crucial role in device performance.
The environmental impact of producing and using 5-Fluoro-2,4-dimethoxyaniline is another area of interest. Efforts are underway to develop greener synthetic methods that minimize waste and reduce energy consumption. Catalytic processes that employ renewable resources are being explored as alternatives to traditional chemical transformations. Such innovations align with global initiatives to promote sustainable chemistry practices.
Future research directions for 5-Fluoro-2,4-dimethoxyaniline may include exploring its potential in drug discovery beyond kinase inhibitors. The compound's structural versatility suggests it could be valuable in developing treatments for infectious diseases or metabolic disorders. Additionally, investigating its role in photodynamic therapy has shown promise due to its ability to generate reactive oxygen species under light irradiation.
In conclusion,5-Fluoro-2,4-dimethoxyaniline (CAS No. 195136-65-3) is a multifaceted compound with significant applications across pharmaceuticals and materials science. Its unique structural features enable diverse functionalities that make it indispensable in modern chemistry research. As scientific understanding advances,the potential uses for this compound are likely to expand,further solidifying its importance in both academic and industrial settings.
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