Cas no 137506-69-5 (2-(2,2,2-Trifluoroethoxy)-4-(trifluoromethyl)pyridine)
2-(2,2,2-Trifluoroethoxy)-4-(trifluoromethyl)pyridine is a fluorinated pyridine derivative characterized by the presence of trifluoroethoxy and trifluoromethyl substituents. This compound is of interest in pharmaceutical and agrochemical research due to its electron-withdrawing properties, which can enhance metabolic stability and bioavailability. The trifluoroethoxy group contributes to increased lipophilicity, while the trifluoromethyl moiety may influence binding affinity in target interactions. Its structural features make it a valuable intermediate for the synthesis of biologically active molecules, particularly in the development of herbicides, fungicides, and pharmaceuticals. The compound's stability under various reaction conditions further supports its utility in synthetic chemistry.
137506-69-5 structure
Product Name:2-(2,2,2-Trifluoroethoxy)-4-(trifluoromethyl)pyridine
CAS No:137506-69-5
MF:C8H5F6NO
MW:245.121823072433
CID:1091450
PubChem ID:54486547
Update Time:2025-06-08
2-(2,2,2-Trifluoroethoxy)-4-(trifluoromethyl)pyridine Chemical and Physical Properties
Names and Identifiers
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- 2-(2,2,2-Trifluoroethoxy)-4-(trifluoromethyl)pyridine
- Pyridine, 2-(2,2,2-trifluoroethoxy)-4-(trifluoromethyl)-
- 137506-69-5
-
- Inchi: 1S/C8H5F6NO/c9-7(10,11)4-16-6-3-5(1-2-15-6)8(12,13)14/h1-3H,4H2
- InChI Key: WQYJZQZDMGBIFV-UHFFFAOYSA-N
- SMILES: FC(C1C=CN=C(C=1)OCC(F)(F)F)(F)F
Computed Properties
- Exact Mass: 245.02753276g/mol
- Monoisotopic Mass: 245.02753276g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 226
- 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: 3.2
- Topological Polar Surface Area: 22.1?2
2-(2,2,2-Trifluoroethoxy)-4-(trifluoromethyl)pyridine Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A029191477-1g |
2-(2,2,2-Trifluoroethoxy)-4-(trifluoromethyl)pyridine |
137506-69-5 | 95% | 1g |
$357.52 | 2022-04-02 | |
| Chemenu | CM173106-1g |
2-(2,2,2-trifluoroethoxy)-4-(trifluoromethyl)pyridine |
137506-69-5 | 95% | 1g |
$*** | 2023-03-30 | |
| Chemenu | CM173106-1g |
2-(2,2,2-trifluoroethoxy)-4-(trifluoromethyl)pyridine |
137506-69-5 | 95% | 1g |
$380 | 2021-08-05 |
2-(2,2,2-Trifluoroethoxy)-4-(trifluoromethyl)pyridine Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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4. Estimation of hydrogen sulfide from crude petroleum: a unique invention using a simple chemosensor?Shampa Kundu,Prithidipa Sahoo New J. Chem., 2019,43, 12369-12374
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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