Category: pyridazines

In an article, author is Chopra, Rashi, once mentioned the application of 375-72-4, Safety of 1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl fluoride, Name is 1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl fluoride, molecular formula is C4F10O2S, molecular weight is 302.0906, MDL number is MFCD00007422, category is pyridazines. Now introduce a scientific discovery about this category.

Electrochemical, Morphological and Anti-corrosive Characteristics of Pyrazine Derivatives for Mild Steel Corrosion in Aggressive Medium: A Comparative Study

The anti-corrosive characteristics of 2,5-dimethylpyrazine (2,5-DMP) and 2,6-dimethylpyrazine (2,6-DMP) on the corrosion of mild steel in 0.5M sulfuric acid have been studied by gravimetric method and electrochemical techniques (potentiodynamic polarization, linear polarization resistance and electrochemical impedance measurement) to observe the adsorption of these pyrazine derivatives at the metal/solution interface. The results obtained have revealed that 2,5-DMP performs more efficiently in comparison with 2,6-DMP showing an efficiency of 97.12% at a concentration of 10(-2)M. The polarization curves clearly indicate that both chemicals act as a mixed-type inhibitors showing a predominance toward the cathodic reaction. Langmuir’s isotherm model was found to adequately describe the adsorption of both these inhibitors onto the mild steel surface. The calculated value of the free energy for the adsorption process, eveals a strong chemisorbed bond as well as a spontaneous adsorption process between the tested inhibitors and the mild steel surface. Surface morphological analysis of the MS specimens treated with these inhibitors has been conducted using energy-sispersive atomic X-ray spectroscopy. The results obtained have shown a good agreement with the results obtained from electrochemical techniques. Quantum chemical calculations have also been performed using hyperchem 8.0.6 package to supplement the findings from the preceding techniques.

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Reference:
Pyridazine – Wikipedia,
,Pyridazine | C4H4N2 – PubChem

 

Chemistry is the experimental science by definition. We want to make observations to prove hypothesis. For this purpose, we perform experiments in the lab. , Quality Control of 3,3,4,4,5,5,6,6,6-Nonafluorohexyl methacrylate, 1799-84-4, Name is 3,3,4,4,5,5,6,6,6-Nonafluorohexyl methacrylate, molecular formula is C10H9F9O2, belongs to pyridazines compound. In a document, author is Swiderski, Grzegorz, introduce the new discover.

Comparison of structural, spectroscopic, theoretical and thermal properties of metal complexes (Zn(II), Mn(II), Cu(II), Ni(II) and Co(II)) of pyridazine-3-carboxylic acid and pyridazine-4-carboxylic acids

In our present work, we studied complexes of 3d-transition metals with pyridazine-3-carboxylic and pyridazine-4-carboxylic acids. The synthesis of manganese(II), cobalt(II), nickel(II), copper(II) and zinc(II) complexes with pyridazinecarboxylic acids was performed. The effect of selected 3d-transition metal ions on the electronic system of ligands and the thermal properties of the complexes by the use of TG-FTIR were studied. The products of dehydration and decomposition processes of studied compounds were determined from the TG (thermo-gravimetric) and DSC (differential scanning calorimetry) curves. The crystal structures of manganese(II) pyr-idazine-3-carboxylate acid and pyridazine-4-carboxylate were analysed by the use of single-crystal X-ray ana-lysis. The geometries, NBO atomic charges, energy of HOMO and LUMO orbitals were calculated in the B3LYP/6-311++G(d,p) level. The aromaticity of ligands and complexes were discussed on the basis of HOMA and Bird’s indices. The influence of the type of metal ion coordination and the location of the carboxylate anion in the pyridazine ring on the aromaticity of complexes were discussed. The comparison of the effect of metal ions on the electronic charge distribution and aromaticity of pyridazynecarboxylic and pyridinecarboxylic acids (i.e. nicotinic and picolinic acids) was done.

A reaction mechanism is the microscopic path by which reactants are transformed into products. Each step is an elementary reaction. In my other articles, you can also check out more blogs about 1799-84-4. Quality Control of 3,3,4,4,5,5,6,6,6-Nonafluorohexyl methacrylate.

Reference:
Pyridazine – Wikipedia,
,Pyridazine | C4H4N2 – PubChem

 

Reference of 88-17-5, Children learn through play, and they learn more than adults might expect. Science experiments are a great way to spark their curiosity, 88-17-5, Name is 2-(Trifluoromethyl)aniline, SMILES is NC1=CC=CC=C1C(F)(F)F, belongs to pyridazines compound. In a article, author is Filali, Mouad, introduce new discover of the category.

Crystal structure, Hirshfeld surface analysis and corrosion inhibition study of 3,6-bis(pyridin-2-yl)-4-{[(3aS,5aR,8aR,8bS)-2,2,7,7-tetrametbyltetra-hydro-5H-bis[1,3]dioxolo[4,5-b:4 ‘,5 ‘-d]pyran-5-yl)-methoxy]methyl}pyriaazine monohydrate

In the title compound, C27H30N4O6 center dot H2O, the two dioxolo rings are in envelope conformations, while the pyran ring is in a twisted-boat conformation. The pyradizine ring is oriented at dihedral angles of 9.23 (6) and 12.98 (9)degrees with respect to the pyridine rings, while the dihedral angle between the two pyridine rings is 13.45 (10)degrees. In the crystal, O-H-water center dot center dot center dot O-pyran, O-H-water center dot center dot center dot O-methoxymethyl and O-H-water center dot center dot center dot N-pyridazine hydrogen bonds link the molecules into chains along [010]. In addition, weak C-H-dioxolo center dot center dot center dot O-dioxolo hydrogen bonds and a weak C-H-methoxymethyl center dot center dot center dot pi interaction complete the three-dimensional structure. The Hirshfeld surface analysis of the crystal structure indicates that the most important contributions for the crystal packing are from H center dot center dot center dot H (55.7%), H center dot center dot center dot C/C center dot center dot center dot H (14.6%), H center dot center dot center dot O/O center dot center dot center dot H (14.5%) and H center dot center dot center dot N/N center dot center dot center dot H (9.6%) interactions. Hydrogen-bonding and van der Waals interactions are the dominant interactions in the crystal packing. Electrochemical measurements are also reported.

Reference of 88-17-5, Each elementary reaction can be described in terms of its molecularity, the number of molecules that collide in that step. The slowest step in a reaction mechanism is the rate-determining step.you can also check out more blogs about 88-17-5.

Reference:
Pyridazine – Wikipedia,
,Pyridazine | C4H4N2 – PubChem

 

Reference of 4949-44-4, The transformation of simple hydrocarbons into more complex and valuable products via catalytic C¨CH bond functionalisation has revolutionised modern synthetic chemistry. 4949-44-4, Name is Ethyl 3-oxopentanoate, SMILES is CCC(CC(OCC)=O)=O, belongs to pyridazines compound. In a article, author is Aniskova, Tatyana, introduce new discover of the category.

Synthesis of Compounds of the Pyrimidine Series Based on the Reactions of 3-Arylmethylidenefuran-(3H)-ones with N,N-Binucleophilic Reagents

The arylmethylidene derivatives of furan-2(3H)-ones are important building blocks for the synthesis of various heterocyclic compounds containing pyrimidine and pyridazine structural fragments, analogues of nitrogen-containing bases of pyrimidine series. In order to continue the development of constructing of molecules containing pyridine and pyridazine fragments, this article is devoted to the synthesis of new biologically active compounds with these moieties. The introduction of a heterocyclic chromenone fragment changes the previously observed 5-R-3-arylmethylidenefuran-2(3H)-ones route of reaction with guanidine carbonate and leads to 3-[(2-amino-4-(2-hydroxyphenyl)pyrimidin-5-yl)methylene]-5-phenylfuran-2(3H)-ones (2a-d). The structure of the reaction products depends on the nature of the aromatic substituent at the C-3 position of the furanone ring. The interaction of 5-aryl-3-arylmethylidenefuran-2(3H)-ones (1e-h) with thiourea in the basic medium leads to the isolation of 5-(2-oxo-2-phenylethyl)6-aryl-2-thioxotetrahydropyrimidine-4(1H)-ones (3a-d), demonstrating pronounced plant-growth regulatory activity. Optimal conditions for all discussed processes were developed.

Reference of 4949-44-4, Because enzymes can increase reaction rates by enormous factors and tend to be very specific, typically producing only a single product in quantitative yield, they are the focus of active research.you can also check out more blogs about 4949-44-4.

Reference:
Pyridazine – Wikipedia,
,Pyridazine | C4H4N2 – PubChem

 

Synthetic Route of 920-66-1, Redox catalysis has been broadly utilized in electrochemical synthesis due to its kinetic advantages over direct electrolysis. The appropriate choice of redox mediator can avoid electrode passivation and overpotential. 920-66-1, Name is 1,1,1,3,3,3-Hexafluoropropan-2-ol, SMILES is OC(C(F)(F)F)C(F)(F)F, belongs to pyridazines compound. In a article, author is Chmovzh, Timofey N., introduce new discover of the category.

3,6-Dibromopyridazine-4,5-diamine

Dihalogenated derivatives of 1,2,5-chalcogenadiazoles fused with benzene or heterocyclic rings are of interest as starting compounds for photovoltaic materials. The 1,2,5-chalcogenadiazole ring in these heterocycles was most commonly prepared from the corresponding ortho-diamine moiety. In this communication, 3,6-dibromopyridazine-4,5-diamine was prepared via the reaction of 4,7-dibromo[1,2,5]thiadiazolo[3,4-d]pyridazine with sodium methoxide in THF by heating at reflux for four hours. The structure of the newly synthesized compound was established by means of high resolution mass-spectrometry, H-1, C-13-NMR and IR spectroscopy, and mass-spectrometry.

Synthetic Route of 920-66-1, Because enzymes can increase reaction rates by enormous factors and tend to be very specific, typically producing only a single product in quantitative yield, they are the focus of active research.you can also check out more blogs about 920-66-1.

Reference:
Pyridazine – Wikipedia,
,Pyridazine | C4H4N2 – PubChem

 

1538-08-5, Name is 2,2,2-Trifluoroacetohydrazide, molecular formula is C2H3F3N2O, belongs to pyridazines compound, is a common compound. In a patnet, author is Reheim, Mohamed A. M. Abdel, once mentioned the new application about 1538-08-5, Quality Control of 2,2,2-Trifluoroacetohydrazide.

Synthesis, characterization and in vitro antimicrobial activity of novel fused pyrazolo[3,4-c] pyridazine, pyrazolo[3,4-d] pyrimidine, thieno[3,2-c] pyrazole and pyrazolo[ 3 ‘, 4 ‘:4,5] thieno[2,3-d] pyrimidine derivatives

Background: Some novel substituted pyrazolone, pyrazolo[3,4-c] pyridazine, pyrazolo[3,4-d] pyrimidine, pyrazolo[3,4d] thiazolo[3,2-a] pyrimidinone, thieno[3,2-c] pyrazole and pyrazolo[3 ‘, 4 ‘:4,5] thieno[2,3-d] pyrimidine derivatives have been reported to possess various pharmacological activities like antimicrobial, antitumor and anti-inflammatory. Results: A novel series of azoles and azines were designed and prepared via reaction of 1,3-diphenyl-1H-pyrazol-5(4H)-one with some electrophilic and nucleophilic reagents. The structures of target compounds were confirmed by elemental analyses and spectral data. Conclusions: The antimicrobial activity of the target synthesized compounds were tested against various microorganisms such as Escherichia coli; Bacillus megaterium; Bacillus subtilis (Bacterial species), Fusarium proliferatum; Trichoderma harzianum; Aspergillus niger (fungal species) by the disc diffusion method. In general, the novel synthesized compounds showed a good antimicrobial activity against the previously mentioned microorganisms.

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Reference:
Pyridazine – Wikipedia,
,Pyridazine | C4H4N2 – PubChem

 

Application of 375-72-4, The transformation of simple hydrocarbons into more complex and valuable products via catalytic C¨CH bond functionalisation has revolutionised modern synthetic chemistry. 375-72-4, Name is 1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl fluoride, SMILES is O=S(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)(F)=O, belongs to pyridazines compound. In a article, author is Fernandes, Sara S. M., introduce new discover of the category.

Synthesis of Pyridazine Derivatives by Suzuki-Miyaura Cross-Coupling Reaction and Evaluation of Their Optical and Electronic Properties through Experimental and Theoretical Studies

A series of -conjugated molecules, based on pyridazine and thiophene heterocycles 3a-e, were synthesized using commercially, or readily available, coupling components, through a palladium catalyzed Suzuki-Miyaura cross-coupling reaction. The electron-deficient pyridazine heterocycle was functionalized by a thiophene electron-rich heterocycle at position six, and different (hetero)aromatic moieties (phenyl, thienyl, furanyl) were functionalized with electron acceptor groups at position three. Density Functional Theory (DFT) calculations were carried out to obtain information on the conformation, electronic structure, electron distribution, dipolar moment, and molecular nonlinear response of the synthesized push-pull pyridazine derivatives. Hyper-Rayleigh scattering in 1,4-dioxane solutions, using a fundamental wavelength of 1064 nm, was used to evaluate their second-order nonlinear optical properties. The thienylpyridazine functionalized with the cyano-phenyl moiety exhibited the largest first hyperpolarizability ( = 175 x 10(-30) esu, using the T convention) indicating its potential as a second harmonic generation (SHG) chromophore.

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Reference:
Pyridazine – Wikipedia,
,Pyridazine | C4H4N2 – PubChem

 

In an article, author is Ben Aissa, Mohamed Ali, once mentioned the application of 4949-44-4, Formula: C7H12O3, Name is Ethyl 3-oxopentanoate, molecular formula is C7H12O3, molecular weight is 144.17, MDL number is MFCD00009317, category is pyridazines. Now introduce a scientific discovery about this category.

Theoretical Density Functional Theory insights into the nature of chalcogen bonding between CX2 (X = S, Se, Te) and diazine from monomer to supramolecular complexes

Chalcogen bonding is a noncovalent interaction, highly similar to halogen and hydrogen bonding, occurring between a chalcogen atom and a nucleophilic region. Two density functional theory (DFT) approaches B3LY-D3 and B97-D3 were performed on a series of complexes formed between CX2 (X = S, Se, Te) and diazine (pyridazine, pyrimidine and pyrazine). Chalcogen atoms prefer interacting with the lone pair of a nitrogen atom rather than with the pi-cloud of an aromatic ring. CTe2 and CSe2 form a stronger chalcogen bond than CS2. The electrostatic potential of CX2 (X = S, Se and Te) reveals the presence of two equivalent sigma-holes, one on each chalcogen atom. These CX2 molecules interact with diazine giving rise to supramolecular interactions. Wiberg bond index and second-order perturbation theory analysis in NBO were performed to better understand the nature of the chalcogen bond interaction.

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Reference:
Pyridazine – Wikipedia,
,Pyridazine | C4H4N2 – PubChem

 

The reaction rate of a catalyzed reaction is faster than the reaction rate of the uncatalyzed reaction at the same temperature. 102-08-9, Name is N,N’-Diphenylthiourea, SMILES is S=C(NC1=CC=CC=C1)NC2=CC=CC=C2, in an article , author is Hatua, Kaushik, once mentioned of 102-08-9, Recommanded Product: 102-08-9.

Diffuse electron of alkali metals (Li, Na, K) or diffuse electron pair of alkaline earth metals (Be, Mg, Ca) which predict larger second hyperpolarizability? A comprehensive study of M center dot center dot center dot NH3 model compounds

In the present work, model M center dot center dot center dot NH3 complexes of alkali and alkaline earth metals are considered to calculate second hyperpolarizability using HF, MP2, CCSD and DFT methods. The diffuse electrons of alkali metals are more efficient than diffuse electron pair of alkaline earth metals in enhancing the magnitude of second hyperpolarizability. The radiation frequency has a dramatic effect on gamma(av). Although MP2 gamma(zzzz) is overestimated by a smaller margin the corresponding gamma(av) fairly agrees with the CCSD result. The large second hyperpolarizability of alkali metal (versus alkaline earth metal) complexes arises from the lower energy intense transition. (C) 2017 Elsevier B.V. All rights reserved.

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Reference:
Pyridazine – Wikipedia,
,Pyridazine | C4H4N2 – PubChem

 

Enzymes are biological catalysts that produce large increases in reaction rates and tend to be specific for certain reactants and products. 88-17-5, Name is 2-(Trifluoromethyl)aniline, molecular formula is C7H6F3N, belongs to pyridazines compound. In a document, author is Singh, Bholey, introduce the new discover, Quality Control of 2-(Trifluoromethyl)aniline.

Synthesis, crystal structures and biological evaluation of new pyridazine derivatives

A series of functionalized pyridazine derivatives (1-10) 4-phenyl-3,6-di(pyridine-4-yl)pyridazine (1), 3(3,6-di(pyridin-4-yl)pyridazin-4-yl)aniline (2), 4-(pyridin-3-yl)-3,6-di(pyridin-4-yl)pyridazine (3), 3,6-di(pyridin-4-yl)-4-(thiophen-2-yl)pyridazine (4), 6-methyl-1,4-di(pyridin-4-yl)-5H-pyrrolo[3,4-d]pyridazine-5,7(6H)-dione (5), 4-phenyl-3,6-di(pyridine-3-yl)pyridazine (6), 3-(3,6-di(pyridin-4-yl)pyridazin-3yl)aniline (7), 3,4,6-tri(pyridin-3-yl)pyridazine (8), 3,6-di(pyridin-3-yl)-4-(thiophen-2-yl)pyridazine (9), 6-methyl-1,4-di(pyridin-3-yl)-5H-pyrrolo[3,4-d]pyridazine-5,7(6H)-dione (10) were synthesized by one-step methodologies which also include Inverse Electron Demand Diels-Alder reaction. The compounds were isolated in high yields without any tedious purification procedures and characterized by NMR, Mass spectrometry, Elemental Analysis and X-ray diffraction techniques. The crystal structures of five compounds were studied. The pyridazines were subjected to anti-microbial evaluations where few of the compounds showed moderate to high activity against most of the bacteria and fungi presented in this study. (C) 2019 Elsevier B.V. All rights reserved.

Balanced chemical reaction does not necessarily reveal either the individual elementary reactions by which a reaction occurs or its rate law. In my other articles, you can also check out more blogs about 88-17-5. Quality Control of 2-(Trifluoromethyl)aniline.

Reference:
Pyridazine – Wikipedia,
,Pyridazine | C4H4N2 – PubChem