| CAS Number | 933041-14-6 |
| Catalog Number | AG00H047 |
| Chemical Name | 6-bromo-4,5-dichloropyridazin-3(2H)-one |
| IUPAC Name | 3-bromo-4,5-dichloro-1H-pyridazin-6-one |
| InChI | InChI=1S/C4HBrCl2N2O/c5-3-1(6)2(7)4(10)9-8-3/h(H,9,10) |
| InChI Key | CIXBFXGEDMRWSN-UHFFFAOYSA-N |
| MDL Number | MFCD11656268 |
| Molecular Formula | C4HBrCl2N2O |
| Molecular Weight | 243.8735 |
| SMILES | C1(=C(C(=NNC1=O)Br)Cl)Cl |
| Synonyms | 6-Bromo-4,5-dichloro-3(2H)-pyridazinone,
933041-14-6,
6-Bromo-4,5-dichloropyridazin-3(2H)-one,
3-bromo-4,5-dichloro-1H-pyridazin-6-one,
SCHEMBL3056629,
DTXSID50704465,
CIXBFXGEDMRWSN-UHFFFAOYSA-N,
ZINC71255464,
DB-029236,
FT-0704670,
6-bromo-4,5-dichloro-2,3-dihydropyridazin-3-one,
|
| Complexity | 248 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.865g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.869g/mol |
| Monoisotopic Mass | 241.865g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 41.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number