| CAS Number | 1548827-73-1 |
| Catalog Number | AG00HYAI |
| Chemical Name | (6-Chloro-5-methoxypyridin-3-yl)boronic acid |
| IUPAC Name | (6-chloro-5-methoxypyridin-3-yl)boronic acid |
| InChI | InChI=1S/C6H7BClNO3/c1-12-5-2-4(7(10)11)3-9-6(5)8/h2-3,10-11H,1H3 |
| InChI Key | OJBRJRLOQQAEOJ-UHFFFAOYSA-N |
| MDL Number | MFCD13189015 |
| Molecular Formula | C6H7BClNO3 |
| Molecular Weight | 187.3887 |
| SMILES | COc1cc(cnc1Cl)B(O)O |
| Synonyms | 1548827-73-1,
(6-chloro-5-methoxypyridin-3-yl)boronic acid,
6-CHLORO-5-METHOXYPYRIDINE-3-BORONIC ACID,
MFCD13189015,
AKOS026671042,
ZINC169956689,
AB67568,
AS-47953,
2-Chloro-3-methoxypyridine-5-boronic acid,
6-CHLORO-5-METHOXYPYRIDIN-3-YLBORONIC ACID,
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| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.021g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.386g/mol |
| Monoisotopic Mass | 187.021g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 62.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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