| CAS Number | 1010101-08-2 |
| Catalog Number | AG00H9EE(AGN-PC-0WRA7B) |
| Chemical Name | 2,6-Dichloro-3-methylpyridine-4-boronic acid pinacol ester |
| IUPAC Name | 2,6-dichloro-3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
| InChI | InChI=1S/C12H16BCl2NO2/c1-7-8(6-9(14)16-10(7)15)13-17-11(2,3)12(4,5)18-13/h6H,1-5H3 |
| InChI Key | DKKHFBMUYZBBJF-UHFFFAOYSA-N |
| MDL Number | MFCD11617878 |
| Molecular Formula | C12H16BCl2NO2 |
| Molecular Weight | 287.9779 |
| SMILES | Clc1nc(Cl)c(c(c1)B1OC(C(O1)(C)C)(C)C)C |
| Synonyms | 1010101-08-2,
2,6-DICHLORO-3-METHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-PYRIDINE,
2,6-Dichloro-3-methylpyridine-4-boronic acid pinacol ester,
2,6-dichloro-3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine,
DTXSID40678207,
ZINC198023501,
D-5219,
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| Complexity | 311 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 287.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 287.975g/mol |
| Monoisotopic Mass | 287.065g/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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