Cas no 2368221-13-8 ((5-fluoro-2-(methyl-d3)pyridin-4-yl-3,6-d2)boronic acid)
2368221-13-8 structure
Product Name:(5-fluoro-2-(methyl-d3)pyridin-4-yl-3,6-d2)boronic acid
CAS No:2368221-13-8
MF:C6H7BFNO2
MW:159.965493440628
CID:6831255
PubChem ID:172403810
Update Time:2025-03-01
(5-fluoro-2-(methyl-d3)pyridin-4-yl-3,6-d2)boronic acid Chemical and Physical Properties
Names and Identifiers
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- CS-18972
- 2368221-13-8
- (5-fluoro-2-(methyl-d3)pyridin-4-yl-3,6-d2)boronic acid
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- Inchi： 1S/C6H7BFNO2/c1-4-2-5(7(10)11)6(8)3-9-4/h2-3,10-11H,1H3/i1D3,2D,3D
- InChI Key： XEKZLTJOECNOMJ-RHIBPKLGSA-N
- SMILES： FC1=C([2H])N=C(C([2H])([2H])[2H])C([2H])=C1B(O)O
Computed Properties
- Exact Mass: 160.0867705Da
- Monoisotopic Mass: 160.0867705Da
- Isotope Atom Count: 5
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 136
- 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
- Topological Polar Surface Area: 53.4?2
(5-fluoro-2-(methyl-d3)pyridin-4-yl-3,6-d2)boronic acid Related Literature
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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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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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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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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