| CAS Number | 1394041-48-5 |
| Catalog Number | AG01A05X(AGN-PC-0WOSOW) |
| Chemical Name | 4-(aminomethyl)-5,6-diethyl-2,3-dihydropyridazin-3-one hydrochloride |
| IUPAC Name | 5-(aminomethyl)-3,4-diethyl-1H-pyridazin-6-one;hydrochloride |
| InChI | InChI=1S/C9H15N3O.ClH/c1-3-6-7(5-10)9(13)12-11-8(6)4-2;/h3-5,10H2,1-2H3,(H,12,13);1H |
| InChI Key | RTPRSZMJBBENOK-UHFFFAOYSA-N |
| MDL Number | MFCD22378637 |
| Molecular Formula | C9H16ClN3O |
| Molecular Weight | 217.6958 |
| SMILES | Cl.NCC=1C(NN=C(C1CC)CC)=O |
| Synonyms | 4-(aminomethyl)-5,6-diethyl-2,3-dihydropyridazin-3-one hydrochloride,
1394041-48-5,
4-(Aminomethyl)-5,6-diethylpyridazin-3(2H)-one hydrochloride,
AKOS026742606,
MCULE-6490377048,
NE19859,
Z1431002737,
|
| Complexity | 279 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.697g/mol |
| Monoisotopic Mass | 217.098g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 67.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number