| CAS Number | 1220696-64-9 |
| Catalog Number | AG003AVV(AGN-PC-0CZBMW) |
| Chemical Name | 3-Fluoro-2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
| IUPAC Name | 3-fluoro-2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
| InChI | InChI=1S/C12H17BFNO2/c1-8-10(14)6-9(7-15-8)13-16-11(2,3)12(4,5)17-13/h6-7H,1-5H3 |
| InChI Key | LKEABTHVRADLLJ-UHFFFAOYSA-N |
| MDL Number | MFCD18382856 |
| Molecular Formula | C12H17BFNO2 |
| Molecular Weight | 237.0783 |
| SMILES | FC=1C(=NC=C(C1)B1OC(C(O1)(C)C)(C)C)C |
| Synonyms | 3-fluoro-2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine,
1220696-64-9,
SCHEMBL2427096,
LKEABTHVRADLLJ-UHFFFAOYSA-N,
|
| Complexity | 282 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.134g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.081g/mol |
| Monoisotopic Mass | 237.134g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 31.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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