| CAS Number | 1456807-59-2 |
| Catalog Number | AG00J246 |
| Chemical Name | 1-Hydrazinylisoquinoline hydrobromide hydrate |
| IUPAC Name | isoquinolin-1-ylhydrazine;hydrate;hydrobromide |
| InChI | InChI=1S/C9H9N3.BrH.H2O/c10-12-9-8-4-2-1-3-7(8)5-6-11-9;;/h1-6H,10H2,(H,11,12);1H;1H2 |
| InChI Key | RPRSKCAMGCWUPK-UHFFFAOYSA-N |
| MDL Number | MFCD26959622 |
| Molecular Formula | C9H12BrN3O |
| Molecular Weight | 258.1151 |
| SMILES | O.Br.N(N)C1=NC=CC2=CC=CC=C12 |
| Synonyms | 1456807-59-2,
1-HYDRAZINOISOQUINOLINE HYDROBROMIDE HYDRATE,
1-Hydrazinylisoquinoline hydrobromide hydrate,
ZX-CM007911,
MFCD26959622,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.016g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.119g/mol |
| Monoisotopic Mass | 257.016g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 51.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number