Cas no 1706436-98-7 (3-Fluoro-4-(trifluoromethyl)picolinonitrile)
3-Fluoro-4-(trifluoromethyl)picolinonitrile is a fluorinated pyridine derivative with significant utility in pharmaceutical and agrochemical research. Its structure, featuring both fluorine and trifluoromethyl substituents, enhances its reactivity and metabolic stability, making it a valuable intermediate in the synthesis of bioactive compounds. The electron-withdrawing properties of the trifluoromethyl and cyano groups contribute to its versatility in nucleophilic substitution and cross-coupling reactions. This compound is particularly useful in the development of heterocyclic scaffolds for drug discovery, offering precise control over molecular interactions. Its high purity and well-defined chemical properties ensure consistent performance in synthetic applications.
1706436-98-7 structure
Product Name:3-Fluoro-4-(trifluoromethyl)picolinonitrile
CAS No:1706436-98-7
MF:C7H2F4N2
MW:190.097795009613
CID:4703753
Update Time:2025-10-22
3-Fluoro-4-(trifluoromethyl)picolinonitrile Chemical and Physical Properties
Names and Identifiers
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- 3-Fluoro-4-(trifluoromethyl)picolinonitrile
- 3-Fluoro-4-(trifluoromethyl)pyridine-2-carbonitrile
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- Inchi: 1S/C7H2F4N2/c8-6-4(7(9,10)11)1-2-13-5(6)3-12/h1-2H
- InChI Key: IZMADNWTONBKAX-UHFFFAOYSA-N
- SMILES: FC(C1C=CN=C(C#N)C=1F)(F)F
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 228
- Topological Polar Surface Area: 36.7
3-Fluoro-4-(trifluoromethyl)picolinonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A029008568-250mg |
3-Fluoro-4-(trifluoromethyl)picolinonitrile |
1706436-98-7 | 95% | 250mg |
$1,038.80 | 2022-04-02 | |
| Alichem | A029008568-1g |
3-Fluoro-4-(trifluoromethyl)picolinonitrile |
1706436-98-7 | 95% | 1g |
$2,779.20 | 2022-04-02 |
3-Fluoro-4-(trifluoromethyl)picolinonitrile Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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