| CAS Number | 65600-69-3 |
| Catalog Number | AG01B6ZF(AGN-PC-0THAVK) |
| Chemical Name | 3-aminopyridin-1-ium-1-olate hydrochloride |
| IUPAC Name | 1-oxidopyridin-1-ium-3-amine;hydrochloride |
| InChI | InChI=1S/C5H6N2O.ClH/c6-5-2-1-3-7(8)4-5;/h1-4H,6H2;1H |
| InChI Key | KQGFTAJGCKDUSW-UHFFFAOYSA-N |
| MDL Number | MFCD30342991 |
| Molecular Formula | C5H7ClN2O |
| Molecular Weight | 146.5749 |
| SMILES | NC1=C[N+]([O-])=CC=C1.[H]Cl |
| Synonyms | 3-aminopyridin-1-ium-1-olate hydrochloride,
65600-69-3,
SCHEMBL14637718,
KQGFTAJGCKDUSW-UHFFFAOYSA-N,
3-aminopyridine-1-oxide hydrochloride,
|
| Complexity | 76.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 146.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 146.574g/mol |
| Monoisotopic Mass | 146.025g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 51.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number