| CAS Number | 959904-53-1 |
| Catalog Number | AG00IJPM(AGN-PC-0WB7B4) |
| Chemical Name | 4-Aminopyridin-3-ylboronic acid hydrochloride |
| IUPAC Name | (4-aminopyridin-3-yl)boronic acid;hydrochloride |
| InChI | InChI=1S/C5H7BN2O2.ClH/c7-5-1-2-8-3-4(5)6(9)10;/h1-3,9-10H,(H2,7,8);1H |
| InChI Key | UWTNNCFLQICMEL-UHFFFAOYSA-N |
| MDL Number | MFCD18427760 |
| Molecular Formula | C5H8BClN2O2 |
| Molecular Weight | 174.3932 |
| SMILES | OB(C1=C(N)C=CN=C1)O.[H]Cl |
| Synonyms | 959904-53-1,
(4-aminopyridin-3-yl)boronic acid hydrochloride,
(4-amino-3-pyridinyl)boronic acid hydrochloride,
SCHEMBL1301715,
UWTNNCFLQICMEL-UHFFFAOYSA-N,
MFCD18427760,
AKOS026743417,
NE60055,
(4-aminopyridin-3-yl)boranediol hydrochloride,
EN300-74216,
4-aminopyridin-3-ylboronic acid hydrochloride salt,
4-aminopyridin-3-ylboronic acid HCl,
(4-amino-3-pyridyl)boronic acid hydrochloric acid,
|
| Complexity | 112 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.037g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.391g/mol |
| Monoisotopic Mass | 174.037g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 79.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number