| CAS Number | 2096333-73-0 |
| Catalog Number | AG00IMIL(AGN-PC-0WQUNT) |
| Chemical Name | 2-Methylpyridine-5-boronic Acid Hydrochloride (contains varying amounts of Anhydride) |
| IUPAC Name | (6-methylpyridin-3-yl)boronic acid;hydrochloride |
| InChI | InChI=1S/C6H8BNO2.ClH/c1-5-2-3-6(4-8-5)7(9)10;/h2-4,9-10H,1H3;1H |
| InChI Key | HBEJHFSGVGEQSH-UHFFFAOYSA-N |
| MDL Number | MFCD19237187 |
| Molecular Formula | C6H9BClNO2 |
| Molecular Weight | 173.4052 |
| SMILES | Cl.CC1=NC=C(B(O)O)C=C1 |
| Synonyms | 6-Methylpyridine-3-boronic acid hydrochloride,
2-Methylpyridine-5-boronic acid, HCl,
2096333-73-0,
(6-Methylpyridin-3-yl)boronic acid hydrochloride,
2-Methylpyridine-5-boronic Acid Hydrochloride (contains varying amounts of Anhydride),
2-Methylpyridine-5-boronic acid HCl,
MFCD19237187,
AKOS027347853,
OR53214,
PS-9786,
2-Picoline-5-Boronic Acid Hydrochloride,
6-Methyl-3-pyridylboronic Acid Hydrochloride,
M2253,
Y2374,
2-Methylpyridine-5-boronic acid hydrochloride,
A-2838,
C6H8BNO2.ClH,
N/A,
659742-21-9,
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| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.403g/mol |
| Monoisotopic Mass | 173.041g/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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