Cas no 126159-64-6 (3-Fluoro-1-methylpyridin-1-ium)
126159-64-6 structure
Product Name:3-Fluoro-1-methylpyridin-1-ium
CAS No:126159-64-6
MF:C6H7FN
MW:112.124884843826
CID:2761265
PubChem ID:20028989
Update Time:2025-04-21
3-Fluoro-1-methylpyridin-1-ium Chemical and Physical Properties
Names and Identifiers
-
- 126159-64-6
- SCHEMBL10256983
- 3-Fluoro-1-methylpyridin-1-ium
- DTXSID50601804
-
- Inchi： 1S/C6H7FN/c1-8-4-2-3-6(7)5-8/h2-5H,1H3/q+1
- InChI Key： SASRUMZGFRERDG-UHFFFAOYSA-N
- SMILES： FC1=CC=C[N+](C)=C1
Computed Properties
- Exact Mass: 112.056252390g/mol
- Monoisotopic Mass: 112.056252390g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 74.9
- 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: 1.1
- Topological Polar Surface Area: 3.9?2
3-Fluoro-1-methylpyridin-1-ium Related Literature
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
126159-64-6 (3-Fluoro-1-methylpyridin-1-ium) Related Products
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