Day: April 20, 2022

Epoxy compounds usually have stronger nucleophilic ability, because the alkyl group on the oxygen atom makes the bond angle smaller, which makes the lone pair of electrons react more dissimilarly with the electron-deficient system. Compound: (R)-2,2′,6,6′-Tetramethoxy-4,4′-bis(diphenylphosphino)-3,3′-bipyridine, is researched, Molecular C38H34N2O4P2, CAS is 221012-82-4, about Delineating Origins of Stereocontrol in Asymmetric Pd-Catalyzed α-Hydroxylation of 1,3-Ketoesters.Product Details of 221012-82-4.

Systematic studies of reaction conditions and subsequent optimization led to the identification of important parameters for stereoselectivity in the asym. α-hydroxylation reaction of 1,3-ketoesters. Enantioselectivities of up to 98% can be achieved for cyclic substrates and 88% for acyclic ketoesters. Subsequently, the combination of cyclic/acyclic ketoester, catalyst, and oxidant was found to have a profound effect on reaction rates and turnover-limiting steps. The stereochem. of the reaction contradicts that observed for other similar electrophilic substitution reactions. This was rationalized by transition-state modeling, which revealed a number of cooperative weak interactions between oxidant, ligand, and counterion, together with C-H/π interactions that cumulatively account for the unusual stereoselectivity.

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Quinoxaline – Wikipedia,
Quinoxaline | C8H6N2 | ChemSpider

Most of the compounds have physiologically active properties, and their biological properties are often attributed to the heteroatoms contained in their molecules, and most of these heteroatoms also appear in cyclic structures. A Journal, Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya called Competing electrophilic aromatization of methylene-1,3- and -1,4-cyclohexadienes, Author is Rozenberg, V. I.; Nikanorov, V. A.; Gorbacheva, R. I.; Reutov, O. A., which mentions a compound: 57825-30-6, SMILESS is CCC1=CC=C(CBr)C=C1, Molecular C9H11Br, SDS of cas: 57825-30-6.

Reaction of 5:1 5-ethyl-6-methylene-1,3- (I) and 3-ethyl-6-methylene-1,4-cyclohexadiene (II) with HgCl2 followed by reduction with LiAlH4 gave 5:1 2- (III) and 4-EtC6H4Me (IV) in 90% overall yield. Adding a 10-fold excess of HCl gave 50:1 III-IV. Reaction of 5:1 I-II with AuBr3 or (Ph3P)AuBr3 gave 3.8:1 III-IV in 17 and 85% combined yield, resp.

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Quinoxaline – Wikipedia,
Quinoxaline | C8H6N2 | ChemSpider

Most of the compounds have physiologically active properties, and their biological properties are often attributed to the heteroatoms contained in their molecules, and most of these heteroatoms also appear in cyclic structures. A Journal, Bulletin de la Societe Chimique de France called Organometallic chemistry. VI. Meerwein reaction. IV. Mechanistic aspects, Author is Al Adel, I.; Adeoti Salami, B.; Levisalles, J.; Rudler, H., which mentions a compound: 32717-95-6, SMILESS is C12=C(CCC3=C4CC2)[Cu+]1534[Cl-][Cu+]678(C9=C6CCC7=C8CC9)[Cl-]5, Molecular C16H16Cl2Cu2, Synthetic Route of C16H16Cl2Cu2.

The key step in the Meerwein reaction of p-ClC6H4N2+ salts in the presence of unsaturated compounds is formation of aryl radicals; complexation of the Cu(I) salt with the unsaturated compound plays only a minor role. Thus, treatment of RCuCl or R2CuBF4 (R = cyclooctadiene) with p-ClC6H4N2+X- (X = Cl, BF4) gives no Meerwein products. Similarly, treatment of CH2:CHCH2OH, which complexes easily with Cu, with p-ClC6H4N2+ and a Cu(I) catalyst gives only 5% of the Meerwein product p-ClC6H4CH2CHClCH2OH. On the other hand, the Meerwein reaction of CH2:CH(CH2)2CH2OH with p-ClC6H4N2+ gives the Meerwein product p-ClC6H4CH2CHCl(CH2)2CH2OH, I [via an aryl intermediate oxidized to a carbocation by Cu(I)], as well as p-ClC6H4N:NCH(CH2C6H4Cl-p)(CH2)2CH2OH and II.

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Quinoxaline – Wikipedia,
Quinoxaline | C8H6N2 | ChemSpider

Formula: C3H12Cl2N2. Aromatic compounds can be divided into two categories: single heterocycles and fused heterocycles. Compound: (S)-Propane-1,2-diamine dihydrochloride, is researched, Molecular C3H12Cl2N2, CAS is 19777-66-3, about Discovery of Potent and Selective Dipeptidyl Peptidase IV Inhibitors Derived from β-Aminoamides Bearing Substituted Triazolopiperazines. Author is Kim, Dooseop; Kowalchick, Jennifer E.; Brockunier, Linda L.; Parmee, Emma R.; Eiermann, George J.; Fisher, Michael H.; He, Huaibing; Leiting, Barbara; Lyons, Kathryn; Scapin, Giovanna; Patel, Sangita B.; Petrov, Aleksandr; Pryor, KellyAnn D.; Roy, Ranabir Sinha; Wu, Joseph K.; Zhang, Xiaoping; Wyvratt, Matthew J.; Zhang, Bei B.; Zhu, Lan; Thornberry, Nancy A.; Weber, Ann E..

A series of β-aminoamides bearing triazolopiperazines have been discovered as potent, selective, and orally active dipeptidyl peptidase IV (DPP-4) inhibitors by extensive structure-activity relationship (SAR) studies around the triazolopiperazine moiety. Among these, compound (I) with excellent in vitro potency (IC50 = 4.3 nM) against DPP-4, high selectivity over other enzymes, and good pharmacokinetic profiles exhibited pronounced in vivo efficacy in an oral glucose tolerance test (OGTT) in lean mice. On the basis of these properties, compound I has been profiled in detail. Further refinement of the triazolopiperazines resulted in the discovery of a series of extremely potent compounds with subnanomolar activity against DPP-4, i.e., 4-fluorobenzyl-substituted compound (II), which is notable for its superior potency (IC50 = 0.18 nM). X-ray crystal structure determination of compounds I and II in complex with DPP-4 enzyme revealed that (R)-stereochem. at the 8-position of triazolopiperazines is strongly preferred over (S) with respect to DPP-4 inhibition.

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Quinoxaline – Wikipedia,
Quinoxaline | C8H6N2 | ChemSpider

Category: quinoxaline. Aromatic heterocyclic compounds can also be classified according to the number of heteroatoms contained in the heterocycle: single heteroatom, two heteroatoms, three heteroatoms and four heteroatoms. Compound: 1-(Bromomethyl)-4-ethylbenzene, is researched, Molecular C9H11Br, CAS is 57825-30-6, about Structure-based rational design, synthesis and antifungal activity of oxime-containing azole derivatives. Author is Xu, Yulan; Sheng, Chunquan; Wang, Wenya; Che, Xiaoying; Cao, Yongbing; Dong, Guoqiang; Wang, Shengzheng; Ji, Haitao; Miao, Zhenyuan; Yao, Jianzhong; Zhang, Wannian.

In an attempt to find novel azole antifungal agents with improved activity and broader spectrum, computer modeling was used to design a series of new azoles with piperidin-4-one O-substituted oxime side chains. Mol. docking studies revealed that they formed hydrophobic and hydrogen-bonding interactions with lanosterol 14α-demethylase of Candida albicans (CACYP51). In vitro antifungal assay indicates that most of the synthesized compounds showed good activity against tested fungal pathogens. In comparison with fluconazole, itraconazole and voriconazole, several compounds (such as I, R = H, 3-Cl, 2-F) show more potent antifungal activity and broader spectrum, suggesting that they are promising leads for the development of novel antifungal agents.

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Quinoxaline – Wikipedia,
Quinoxaline | C8H6N2 | ChemSpider

Recommanded Product: 8-Hydroxyquinoline 1-oxide. Aromatic heterocyclic compounds can also be classified according to the number of heteroatoms contained in the heterocycle: single heteroatom, two heteroatoms, three heteroatoms and four heteroatoms. Compound: 8-Hydroxyquinoline 1-oxide, is researched, Molecular C9H7NO2, CAS is 1127-45-3, about Theoretical investigation of the second and third order nonlinear optical properties of some fused heterocyclic aromatic compounds. Author is Bader, Mamoun M..

The authors report herein the results of coupled perturbed Hartree-Fock (CPHF) ab initio extended basis set calculations on the geometric structures, dipole moments, static 1st-order (α), 2nd-order (β), and 3rd-order polarizabilities (γ) of fused heterocyclic aromatic compounds based on quinoline. The effects of the presence/absence of the heteroatom as well as the introduction of other substituents at various positions in the ring system on these mol. properties are described. The effect of the presence of N-oxide is also examined Suggestions for the design of heterocyclic systems with enhanced polarizabilities are made.

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Quinoxaline – Wikipedia,
Quinoxaline | C8H6N2 | ChemSpider

The three-dimensional configuration of the ester heterocycle is basically the same as that of the carbocycle. Compound: Chloro(1,5-cyclooctadiene)copper(I) dimer(SMILESS: C12=C(CCC3=C4CC2)[Cu+]1534[Cl-][Cu+]678(C9=C6CCC7=C8CC9)[Cl-]5,cas:32717-95-6) is researched.Name: (S)-Propane-1,2-diamine dihydrochloride. The article 《Olefin-Supported Cationic Copper Catalysts for Photochemical Synthesis of Structurally Complex Cyclobutanes》 in relation to this compound, is published in Angewandte Chemie, International Edition. Let’s take a look at the latest research on this compound (cas:32717-95-6).

The sole method available for the photocycloaddition of unconjugated aliphatic alkenes is the Cu-catalyzed Salomon-Kochi reaction. The [Cu(OTf)]2·benzene catalyst that has been standard in this reaction for many decades, however, is air-sensitive, prone to photodecomposition, and poorly reactive towards sterically bulky alkene substrates. Using bench-stable precursors, an improved catalyst system with superior reactivity and photostability has been designed, and it offers significantly expanded substrate scope. The utility of this new catalyst for the preparation of sterically crowded cyclobutane structures is highlighted through the preparation of the cores of the natural products sulcatine G and perforatol.

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Quinoxaline – Wikipedia,
Quinoxaline | C8H6N2 | ChemSpider

Name: (S)-Propane-1,2-diamine dihydrochloride. The reaction of aromatic heterocyclic molecules with protons is called protonation. Aromatic heterocycles are more basic than benzene due to the participation of heteroatoms. Compound: (S)-Propane-1,2-diamine dihydrochloride, is researched, Molecular C3H12Cl2N2, CAS is 19777-66-3, about Vitamin B12 Mimics Having a Peptide Backbone and Tuneable Coordination and Redox Properties. Author is Zhou, Kai; Zelder, Felix.

The coordination chem. and electrochem. properties of vitamin B12 mimics were studied. The model complexes have a peptide linkage between the corrin macrocycle and the axially coordinated dimethylbenzimidazole base. The dimethylbenzimidazole dissociation and Co(III)/Co(II) redox equilibrium were studied in relation to the peptide linking groups.

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Reference:
Quinoxaline – Wikipedia,
Quinoxaline | C8H6N2 | ChemSpider

Xing, Ai-ping; Wang, Lai-lai; Kwok, Waihim published the article 《Asymmetric amidocarbonylation of aldehyde and acetamide catalyzed by chiral palladium or rhodium complexes》. Keywords: chiral palladium rhodium catalyst asym amidocarbonylation aldehyde acetamide.They researched the compound: (R)-2,2′,6,6′-Tetramethoxy-4,4′-bis(diphenylphosphino)-3,3′-bipyridine( cas:221012-82-4 ).SDS of cas: 221012-82-4. Aromatic heterocyclic compounds can be divided into two categories: single heterocyclic and fused heterocyclic. In addition, there is a lot of other information about this compound (cas:221012-82-4) here.

The in situ prepared chiral catalyst of Pd/unchelating bidentate phosphine ligand L1 (DPPFF), bipyridine bidentate phosphine ligand L2 (P-PHOS), and bidentate phosphine ligand L3 ((S, Rp) -BPPF), and Rh/phosphite ligands L4-L6, have been applied in amidocarbonylation of cyclohexanecarboxaldehyde or phenylacetaldehyde. Pd/bipyridine bidentate phosphine ligand L2 gave the enantioselectivity 25% (S) and the yield 11% in amidocarbonylation of phenylacetaldehyde, When Pd/unchelating bidentate phosphine ligand L1 was employed in asym. amidocarbonylation of cyclohexanecarboxaldehyde, the enantioselectivity 4.3% (S) and the yield 15% were received.

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Quinoxaline – Wikipedia,
Quinoxaline | C8H6N2 | ChemSpider

Computed Properties of C3H12Cl2N2. The reaction of aromatic heterocyclic molecules with protons is called protonation. Aromatic heterocycles are more basic than benzene due to the participation of heteroatoms. Compound: (S)-Propane-1,2-diamine dihydrochloride, is researched, Molecular C3H12Cl2N2, CAS is 19777-66-3, about Synthesis of a water-soluble chiral NMR shift reagent: (S)-PDTA. Author is Florini, Nicola; Arnaud, Gaelle F.; Konya, Balint; Zucchi, Claudia; Palyi, Gyula.

A five-step synthesis of the water-soluble chiral polydentate ligand, (S)-PDTA (I) starting from L-alanine has been worked out, via 5 steps with retention of chirality. The total yield is 50.7% (average of ∼88% for each step), while published methods report 33.4% total yield over four steps.

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Reference:
Quinoxaline – Wikipedia,
Quinoxaline | C8H6N2 | ChemSpider