| CAS Number | 2223049-72-5 |
| Catalog Number | AG01DX8C |
| Chemical Name | 3-bromo-2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
| IUPAC Name | 3-bromo-2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
| InChI | InChI=1S/C11H14BBrClNO2/c1-10(2)11(3,4)17-12(16-10)7-5-8(13)9(14)15-6-7/h5-6H,1-4H3 |
| InChI Key | KDYZOTKUMURSEE-UHFFFAOYSA-N |
| MDL Number | MFCD16995190 |
| Molecular Formula | C11H14BBrClNO2 |
| Molecular Weight | 318.4024 |
| SMILES | BrC=1C(=NC=C(C1)B1OC(C(O1)(C)C)(C)C)Cl |
| Synonyms | 3-BROMO-2-CHLORO-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDINE,
2223049-72-5,
MB17545,
AS-55444,
|
| Complexity | 287 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 316.999g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 318.402g/mol |
| Monoisotopic Mass | 316.999g/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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