| CAS Number | 2129628-93-7 |
| Catalog Number | AG01EHHM |
| Chemical Name | [5-Fluoro-2-(oxan-4-yloxy)pyridin-4-yl]boronic acid |
| IUPAC Name | [5-fluoro-2-(oxan-4-yloxy)pyridin-4-yl]boronic acid |
| InChI | InChI=1S/C10H13BFNO4/c12-9-6-13-10(5-8(9)11(14)15)17-7-1-3-16-4-2-7/h5-7,14-15H,1-4H2 |
| InChI Key | HAJFKAUNYUPCIM-UHFFFAOYSA-N |
| MDL Number | MFCD28385196 |
| Molecular Formula | C10H13BFNO4 |
| Molecular Weight | 241.0239 |
| SMILES | OB(c1cc(OC2CCOCC2)ncc1F)O |
| Synonyms | 2129628-93-7,
[5-Fluoro-2-(oxan-4-yloxy)pyridin-4-yl]boronic acid,
(5-Fluoro-2-((tetrahydro-2H-pyran-4-yl)oxy)pyridin-4-yl)boronic acid,
AKOS027363821,
ZINC228983982,
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| Complexity | 240 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.025g/mol |
| Monoisotopic Mass | 241.092g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 71.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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