3(2H)-Pyridazinone, 4,5-dichloro-2-[4-(trifluoromethyl)phenyl]-


Chemical Name: 3(2H)-Pyridazinone, 4,5-dichloro-2-[4-(trifluoromethyl)phenyl]-
CAS Number: 62436-07-1
Product Number: AG00EB0E(AGN-PC-0KKVVB)
Synonyms:
MDL No:
Molecular Formula: C11H5Cl2F3N2O
Molecular Weight: 309.0714096

Identification/Properties


Properties
MP:
139-140 °C
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
309.069g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
307.973g/mol
Monoisotopic Mass:
307.973g/mol
Topological Polar Surface Area:
32.7A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
440
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



In chemical synthesis, 4,5-Dichloro-2-(4-(trifluoromethyl)phenyl)pyridazin-3(2H)-one is a versatile compound that serves as a valuable building block for the creation of advanced materials and pharmaceuticals. Its unique structure and functional groups make it a key intermediate in the development of various organic compounds with diverse applications. The presence of dichloro, trifluoromethyl, and pyridazinone moieties in this compound allows for selective functionalization and modification, enabling chemists to tailor its reactivity for specific synthetic pathways. Whether used as a key starting material or as a reactive intermediate, 4,5-Dichloro-2-(4-(trifluoromethyl)phenyl)pyridazin-3(2H)-one plays a crucial role in designing novel molecules with enhanced properties and performance.