| CAS Number | 33098-12-3 |
| Catalog Number | AG019UB3 |
| Chemical Name | 4,5-dichloro-2-(3,4-dichlorophenyl)-2,3-dihydropyridazin-3-one |
| IUPAC Name | 4,5-dichloro-2-(3,4-dichlorophenyl)pyridazin-3-one |
| InChI | InChI=1S/C10H4Cl4N2O/c11-6-2-1-5(3-7(6)12)16-10(17)9(14)8(13)4-15-16/h1-4H |
| InChI Key | IBSVTXVNXHJDSO-UHFFFAOYSA-N |
| MDL Number | MFCD09051343 |
| Molecular Formula | C10H4Cl4N2O |
| Molecular Weight | 309.9636 |
| SMILES | ClC1=C(Cl)C=C(N2C(=O)C(Cl)=C(Cl)C=N2)C=C1 |
| Synonyms | 4,5-dichloro-2-(3,4-dichlorophenyl)-2,3-dihydropyridazin-3-one,
33098-12-3,
AC1Q3HMT,
SCHEMBL10332513,
CTK6H1168,
STL451529,
ZINC22152608,
AKOS000134746,
MCULE-2049883485,
NE19602,
EN300-41150,
2-(3,4-Dichlorophenyl)-4,5-dichloropyridazine-3(2H)-one,
4,5-dichloro-2-(3,4-dichlorophenyl)pyridazin-3(2H)-one,
|
| Complexity | 396 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 309.905g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 309.955g/mol |
| Monoisotopic Mass | 307.908g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number