| CAS Number | 1955523-54-2 |
| Catalog Number | AG01C589 |
| Chemical Name | (5-Methoxypyridin-3-Yl)Methanamine Dihydrochloride |
| IUPAC Name | (5-methoxypyridin-3-yl)methanamine;dihydrochloride |
| InChI | InChI=1S/C7H10N2O.2ClH/c1-10-7-2-6(3-8)4-9-5-7;;/h2,4-5H,3,8H2,1H3;2*1H |
| InChI Key | JNXPWXNUGHOOQD-UHFFFAOYSA-N |
| MDL Number | MFCD27923675 |
| Molecular Formula | C7H12Cl2N2O |
| Molecular Weight | 211.0890 |
| SMILES | COC1=CN=CC(CN)=C1.Cl.Cl |
| Synonyms | (5-Methoxypyridin-3-yl)methanamine dihydrochloride,
1955523-54-2,
|
| Complexity | 97.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.086g/mol |
| Monoisotopic Mass | 210.033g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number