| CAS Number | 2059942-27-5 |
| Catalog Number | AG01C0KM |
| Chemical Name | (3-Bromopyridin-4-Yl)Methanamine Dihydrochloride |
| IUPAC Name | (3-bromopyridin-4-yl)methanamine;dihydrochloride |
| InChI | InChI=1S/C6H7BrN2.2ClH/c7-6-4-9-2-1-5(6)3-8;;/h1-2,4H,3,8H2;2*1H |
| InChI Key | NMZYXXLUZZJLIJ-UHFFFAOYSA-N |
| MDL Number | MFCD16988642 |
| Molecular Formula | C6H9BrCl2N2 |
| Molecular Weight | 259.9591 |
| SMILES | NCC1=C(Br)C=NC=C1.[H]Cl.[H]Cl |
| Synonyms | (3-Bromopyridin-4-yl)methanamine dihydrochloride,
2059942-27-5,
AX8326568,
Z2731710898,
|
| Complexity | 87.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.933g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 259.956g/mol |
| Monoisotopic Mass | 257.933g/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