| CAS Number | 1334405-66-1 |
| Catalog Number | AG009J1L |
| Chemical Name | 3-Chloro-2-methylpyridine-5-boronic acid |
| IUPAC Name | (5-chloro-6-methylpyridin-3-yl)boronic acid |
| InChI | InChI=1S/C6H7BClNO2/c1-4-6(8)2-5(3-9-4)7(10)11/h2-3,10-11H,1H3 |
| InChI Key | FNHKINFYFJFHCC-UHFFFAOYSA-N |
| MDL Number | MFCD18255104 |
| Molecular Formula | C6H7BClNO2 |
| Molecular Weight | 171.3893 |
| SMILES | B(c1cc(c(nc1)C)Cl)(O)O |
| Synonyms | 3-CHLORO-2-METHYLPYRIDINE-5-BORONIC ACID,
(5-CHLORO-6-METHYLPYRIDIN-3-YL)BORONIC ACID,
1334405-66-1,
AB74638,
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| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.387g/mol |
| Monoisotopic Mass | 171.026g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 53.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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