| CAS Number | 1380300-42-4 |
| Catalog Number | AG009XJ8 |
| Chemical Name | (5-Chloropyridin-3-yl)methanamine dihydrochloride |
| IUPAC Name | (5-chloropyridin-3-yl)methanamine;dihydrochloride |
| InChI | InChI=1S/C6H7ClN2.2ClH/c7-6-1-5(2-8)3-9-4-6;;/h1,3-4H,2,8H2;2*1H |
| InChI Key | OKMPCMOEKBVLIC-UHFFFAOYSA-N |
| MDL Number | MFCD22375703 |
| Molecular Formula | C6H9Cl3N2 |
| Molecular Weight | 215.5081 |
| SMILES | Cl.Cl.NCC1=CC(Cl)=CN=C1 |
| Synonyms | (5-Chloropyridin-3-yl)methanamine dihydrochloride,
1380300-42-4,
ZX-RL005659,
KS-7327,
OR306471,
|
| Complexity | 87.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.983g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.502g/mol |
| Monoisotopic Mass | 213.983g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number