Cas no 119489-67-7 (Benzenamine,3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-)
Benzenamine,3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzenamine,3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-
- 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)aniline
- 3-(Heptadecafluorooctyl)aniline
- 3-(n-perfluorooctyl)aniline
- 3-(perfluoro-n-octyl)benzenamine
- 3-(Perfluorooctyl)aniline
- m-perfluorooctyl aniline
- DTXSID30401167
- 119489-67-7
- NS00109867
- SCHEMBL2263254
- 3-(Heptadecafluorooctyl)aniline, >=95.0%
- J-004140
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- MDL: MFCD03791092
- Inchi: 1S/C14H6F17N/c15-7(16,5-2-1-3-6(32)4-5)8(17,18)9(19,20)10(21,22)11(23,24)12(25,26)13(27,28)14(29,30)31/h1-4H,32H2
- InChI Key: FQQMUCAKAYUZFS-UHFFFAOYSA-N
- SMILES: FC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C1C=CC=C(C=1)N)(F)F)(F)F)(F)F)F
Computed Properties
- Exact Mass: 511.02300
- Monoisotopic Mass: 511.023
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 18
- Heavy Atom Count: 32
- Rotatable Bond Count: 7
- Complexity: 679
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 6.8
- Topological Polar Surface Area: 26A^2
Experimental Properties
- Color/Form: slice
- Density: 1.61
- Melting Point: 33-38?°C
- Boiling Point: 271.1°C at 760 mmHg
- Flash Point: 120.5°C
- Refractive Index: 1.359
- PSA: 26.02000
- LogP: 7.31590
- Solubility: Not determined
Benzenamine,3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)- Security Information
- Hazardous Material transportation number:NONH for all modes of transport
- WGK Germany:3
- FLUKA BRAND F CODES:10-23
Benzenamine,3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | 73037-5G-F |
Benzenamine,3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)- |
119489-67-7 | ≥95.0% | 5G |
¥2039.79 | 2022-02-24 |
Benzenamine,3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)- Related Literature
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Elena Tom?ík,Panagiotis Dallas,Ivana ?eděnková,Jan Svoboda,Martin Hruby RSC Adv. 2021 11 18852
Additional information on Benzenamine,3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-
Benzenamine, 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-: A Comprehensive Overview in Modern Chemical Research
Benzenamine, specifically the derivative 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-, represents a fascinating compound at the intersection of organic chemistry and pharmaceutical innovation. This unique molecular structure combines the aromatic stability of benzene with a highly fluorinated alkyl chain, making it a subject of intense interest in both academic research and industrial applications.
The introduction of fluorine atoms into organic molecules is a well-established strategy to modulate physicochemical properties such as lipophilicity and metabolic stability. In the case of 3-(1,1,2,2,3,3,4,4,5,5,6,6,7 ,7 ,8 ,8 ,8-heptadecafluorooctyl)-benzenamine, the extensive fluorination of the octyl chain significantly enhances its hydrophobicity while maintaining the electron-donating nature of the amine group. This balance makes it an attractive candidate for drug design and material science applications.
Recent studies have highlighted the potential of fluorinated amines in developing novel therapeutic agents. The fluorine atoms not only improve the compound's bioavailability by reducing rapid metabolic degradation but also allow for fine-tuning of its interaction with biological targets. For instance, researchers have explored its utility as a building block in designing kinase inhibitors, where the fluorinated side chain can mimic natural substrates while enhancing binding affinity.
The synthesis of Benzenamine, 3-(1 ,1 ,2 ,2 ,3 ,3 ,4 ,4 ,5 ,5 ,6 ,6 ,7 ,7 ,8 ,8 ,8-heptadecafluorooctyl)- has been refined through advanced synthetic methodologies, including palladium-catalyzed cross-coupling reactions and fluorination techniques. These methods ensure high yield and purity, crucial for pharmaceutical applications. The growing interest in this compound is also driven by its potential as an intermediate in producing more complex molecules with tailored properties.
In material science, the unique characteristics of 3-(1, 1, 2, 2, 3, 3, 4, 4, 5, 5, 6, 6, 7, 7, 8, 8, 8-heptadecafluorooctyl)-benzenamine have been exploited in developing advanced polymers and coatings. The fluorinated side chain imparts thermal stability and chemical resistance, making it suitable for high-performance materials used in harsh environments. Additionally, its ability to form stable complexes with metal ions has opened avenues for applications in catalysis and sensor technology.
In conclusion,Benzenamine, 3-(1, 1, 2, 2, 3, 3, 4, 4, 5, 5, 6, 6, 7, 7, 8, 8, 8-heptadecafluorooctyl)- stands as a testament to the ingenuity of modern chemical research. Its multifaceted applications across pharmaceuticals and materials science underscore its significance as a versatile molecular scaffold. As research continues to uncover new possibilities, this compound is poised to play an increasingly pivotal role in shaping future innovations.
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