| CAS Number | 212622-32-7 |
| Catalog Number | AG01E7MW |
| Chemical Name | 4-Chloro-5-(methylamino)-2,3-dihydropyridazin-3-one |
| IUPAC Name | 5-chloro-4-(methylamino)-1H-pyridazin-6-one |
| InChI | InChI=1S/C5H6ClN3O/c1-7-3-2-8-9-5(10)4(3)6/h2H,1H3,(H2,7,9,10) |
| InChI Key | LRJLZXFFOZLZHM-UHFFFAOYSA-N |
| MDL Number | MFCD20231940 |
| Molecular Formula | C5H6ClN3O |
| Molecular Weight | 159.5736 |
| SMILES | CNC1=C(Cl)C(=O)NN=C1 |
| Synonyms | 212622-32-7,
4-Chloro-5-(methylamino)pyridazin-3(2H)-one,
4-chloro-5-(methylamino)-2,3-dihydropyridazin-3-one,
HMS3437O12,
ZINC35537731,
AKOS017338329,
4-Chloro-5-(methylamino)pyridazine-3(2H)-one,
Z2491387504,
CID10725642,
4-chloro-5-methylamino-2H-pyridazin-3-one,
|
| Complexity | 221 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.573g/mol |
| Monoisotopic Mass | 159.02g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 53.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
Lot Number