| CAS Number | 1315365-13-9 |
| Catalog Number | AG01AJHH(AGN-PC-0WOV9C) |
| Chemical Name | 1-(pyridazin-3-yl)-1,4-diazepane dihydrobromide |
| IUPAC Name | 1-pyridazin-3-yl-1,4-diazepane;dihydrobromide |
| InChI | InChI=1S/C9H14N4.2BrH/c1-3-9(12-11-5-1)13-7-2-4-10-6-8-13;;/h1,3,5,10H,2,4,6-8H2;2*1H |
| InChI Key | LPOMMSPMAIPIMZ-UHFFFAOYSA-N |
| MDL Number | MFCD19382297 |
| Molecular Formula | C9H16Br2N4 |
| Molecular Weight | 340.0581 |
| SMILES | Br.Br.C1CN(C2=NN=CC=C2)CCNC1 |
| Synonyms | 1-(pyridazin-3-yl)-1,4-diazepane dihydrobromide,
1315365-13-9,
AKOS026744352,
MCULE-5918866772,
NE16507,
EN300-80775,
Z1575304404,
|
| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 339.972g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 340.063g/mol |
| Monoisotopic Mass | 337.974g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number