Month: April 2022

In organic chemistry, atoms other than carbon and hydrogen are generally referred to as heteroatoms. The most common heteroatoms are nitrogen, oxygen and sulfur. Now I present to you an article called Solvent-Controlled Intermolecular Proton-Transfer Follows an Irreversible Eigen-Weller Model from fs to ns, published in 2021-12-31, which mentions a compound: 78-50-2, mainly applied to solvent controlled intermol proton transfer, Name: Tri-n-octylphosphine Oxide.

Intermol. Proton Transfer (PT) dynamics can be best studied by optical spectroscopy, which can cover the vast timescale spanned by the process. PT in a hydrogen bonding complex between a pyranine-based photoacid and a trialkyl-phosphine oxide is addressed. The photoreaction is traced with the help of femtosecond transient absorption and picosecond-resolved fluorescence. Characteristic kinetics and spectra of the intervening species are isolated by global anal. and spectral decomposition of time-resolved fluorescence. It is found that the shared proton shifts towards the phosphine site upon photoexcitation in acetonitrile. The process occurs on the sub-picosecond timescale, essentially, under solvent control. Despite the ultrafast rate, an equilibrium between the complex and the hydrogen-bonded ion pair (HBIP) is established. Further reaction steps are delayed to the nanosecond timescale, where formation of the excited deprotonated form is observed The far-reaching consistency between the various methods supports an irreversible Eigen-Weller mechanism in the excited state.

From this literature《Solvent-Controlled Intermolecular Proton-Transfer Follows an Irreversible Eigen-Weller Model from fs to ns》,we know some information about this compound(78-50-2)Name: Tri-n-octylphosphine Oxide, but this is not all information, there are many literatures related to this compound(78-50-2).

Reference:
Chapter 1 An introduction to palladium catalysis,
Palladium/carbon catalyst regeneration and mechanical application method

The reaction of an aromatic heterocycle with a proton is called a protonation. One of articles about this theory is 《Selective reduction of 2,2′,4,4′-tetranitrobiphenyl》. Authors are Bailey, William J..The article about the compound:Isoquinolin-6-olcas:7651-82-3,SMILESS:OC1=CC2=C(C=NC=C2)C=C1).Application In Synthesis of Isoquinolin-6-ol. Through the article, more information about this compound (cas:7651-82-3) is conveyed.

Adding (1 hr.) 152 g. Na2S and 48 g. NaHCO3 in 400 cc. warm H2O to 67 g. [2,4-(O2N)2C6H3]2, m. 163-4°, in 2.5 l. boiling MeOH with stirring and avoiding a large excess of Na2S throughout the reaction, and concentrating the filtered solution give 2 crops totaling 62% 2,2′-dinitrobenzidine, m. 212-14° [N,N’-Ac2 derivative, 81%, m. 292-3° (decomposition)], identical with that obtained on nitration of benzidine with NaNO3 and H2SO4 according to Tauber [Ber. 28, 379(1890)].

From this literature《Selective reduction of 2,2′,4,4′-tetranitrobiphenyl》,we know some information about this compound(7651-82-3)Application In Synthesis of Isoquinolin-6-ol, but this is not all information, there are many literatures related to this compound(7651-82-3).

Reference:
Chapter 1 An introduction to palladium catalysis,
Palladium/carbon catalyst regeneration and mechanical application method

Kim, Chang-Kyu; Nakazawa, Dante; Duhamel, Georges; Raptis, Konstantinos; Ruas, Alexandre published an article about the compound: Tri-n-octylphosphine Oxide( cas:78-50-2,SMILESS:CCCCCCCCP(CCCCCCCC)(CCCCCCCC)=O ).Synthetic Route of C24H51OP. Aromatic heterocyclic compounds can be classified according to the number of heteroatoms or the size of the ring. The authors also want to convey more information about this compound (cas:78-50-2) through the article.

Abstract: A combined method of high-resolution gamma spectroscopy and thermal ionization mass spectroscopy without chem. separation was applied for plutonium assay in pure Pu and U-Pu mixed solutions collected at the Rokkasho Reprocessing Plant, Japan. The relative biases of Pu assay results determined by the combined method to the conventional IDMS are less than 0.01% in the pure Pu and the U-Pu mixed solutions The combined method can be used as an alternative rapid method for Pu assay as a backup to the conventional IDMS method and K-edge densitometry without any loss of precision and accuracy.

From this literature《Improved combined HRGS-TIMS method for rapid determination of Pu in nuclear material samples collected in the Rokkasho reprocessing plant》,we know some information about this compound(78-50-2)Synthetic Route of C24H51OP, but this is not all information, there are many literatures related to this compound(78-50-2).

Reference:
Chapter 1 An introduction to palladium catalysis,
Palladium/carbon catalyst regeneration and mechanical application method

COA of Formula: C6H5NO3. So far, in addition to halogen atoms, other non-metallic atoms can become part of the aromatic heterocycle, and the target ring system is still aromatic. Compound: 5-Hydroxynicotinic acid, is researched, Molecular C6H5NO3, CAS is 27828-71-3, about Application of the Hammett equation to substituted pyridines.

Rates of hydrolysis of Et 5-substituted nicotinates and pKa’s of 5-substituted nicotinic acids were measured and the Hammett relations discussed. Acetylation of 5-aminonicotinic acid (I) gave 5-acetamidonicotinic acid, m. 160-1°. Heating 30 g. 5-bromonicotinic acid, 25 g. KOH, 6 g. CuSO4·5H2O, 6 g. Na tartrate and 100 ml. H2O for 48 hrs. at 170-80° gave 65% 5-hydroxynicotinic acid, m. 292-3°. Methylation of Et 5-hydroxynicotinate with CH2N2 gave Et 5-methoxynicotinate, m. 42.5-3.5°, hydrolysis of which gave 5-methoxynicotinic acid, m. 136-7°. Oxidation of 10 g. I with 100 ml. 30% H2O2 and 200 ml. fuming H2SO4 (d. = 1.93) yielded 43% 5-nitronicotinic acid, m. 171-2°. The rates of hydrolysis of Et esters in 85 weight % EtOH with NaOH were obtained at 0°, 15° and 25° (5-substituent, Ea and log A given): Br, 16.5, 12.3; Cl, 17.5, 13.0; MeO, 15.8, 12.0; H, 17.0, 12.5; Me, 17.4, 12.9; NH2, 18.7, 13.7. The following Hammett equations were obtained: log k = 2.26 σm – 1.60 at 25°; log k = 2.13 σm – 1.99 at 15°; log k = 2.32 σm – 2.74 at 0°. The ratio of ρ at 25° for nicotinates and ρ at 25° for benzoates is 0.89. pKa’s obtained in 50 volume % EtOH at 25° for the following 5-substituted nicotinates were as follows: Me 4.92, H 4.70, MeO 4.57, Br 4.02, NO2 3.55. Thus log Ka = 1.73 σm – 4.75 hold. The ratio of ρ to that of substituted benzoic acids is 1.08. Thus the ratio of ρ’s of pyridine and benzene analogs is close to unity when cross-conjugation among substituents, reacting group, and N does not exist.

From this literature《Application of the Hammett equation to substituted pyridines》,we know some information about this compound(27828-71-3)COA of Formula: C6H5NO3, but this is not all information, there are many literatures related to this compound(27828-71-3).

Reference:
Chapter 1 An introduction to palladium catalysis,
Palladium/carbon catalyst regeneration and mechanical application method

Recommanded Product: 78-50-2. 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: Tri-n-octylphosphine Oxide, is researched, Molecular C24H51OP, CAS is 78-50-2, about Enhancing Cerium Recovery from Leaching Solution of Glass Polishing Powder Waste Using Imidazolium Ionic Liquid. Author is Asadollahzadeh, Mehdi; Torkaman, Rezvan; Torab-Mostaedi, Meisam; Hemmati, Alireza.

One of the high-tech industries is glass polishing, which is associated with the release of large volumes of wastewater, a rich source of rare-earth metals, especially cerium. In this study, cerium ion recovery from glass polishing powder waste using green solvents for extraction was investigated. Reaction time, temperature, organic to aqueous ratio, extractant concentrations, and the synergistic effects of imidazolium ionic liquids and trioctylphosphine oxide and tributylphosphate as extractants were optimized. The co-extraction of lanthanum, a significant problem in extracting cerium, was reduced by enhancement of their separation factor (∼ 17). The cerium-bearing organic solvent was stripped with 0.5 mol/L HNO3 to attain a recovery of cerium by 99.98%. The ionic liquids are useful in the extraction process, enabling higher yields of cerium and reducing the consumption of acids in the stripping stage.

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Reference:
Chapter 1 An introduction to palladium catalysis,
Palladium/carbon catalyst regeneration and mechanical application method

Name: 5-Hydroxynicotinic acid. The protonation of heteroatoms in aromatic heterocycles can be divided into two categories: lone pairs of electrons are in the aromatic ring conjugated system; and lone pairs of electrons do not participate. Compound: 5-Hydroxynicotinic acid, is researched, Molecular C6H5NO3, CAS is 27828-71-3, about Increase in erythrocyte hemolytic resistance by nitrogen heterocyclic derivatives. Author is Braginskaya, F. I.; Kruglyakova, K. E.; Smirnov, L. D.; Zorina, O. M.; Zhumabaeva, T. T..

Four pyridines, 2 pyrimidines, and 2 benzimidazoles were screened for their ability to inhibit ultrasonic hemolysis and acetylcholinesterase  [9000-81-1] of human erythrocytes. The greatest membrane-stabilizing effect, as well as the greatest enzyme-inhibiting effect, was associated with Me-substituted pyrimidines and benzimidazoles.

From this literature《Increase in erythrocyte hemolytic resistance by nitrogen heterocyclic derivatives》,we know some information about this compound(27828-71-3)Name: 5-Hydroxynicotinic acid, but this is not all information, there are many literatures related to this compound(27828-71-3).

Reference:
Chapter 1 An introduction to palladium catalysis,
Palladium/carbon catalyst regeneration and mechanical application method

Most of the natural products isolated at present are heterocyclic compounds, so heterocyclic compounds occupy an important position in the research of organic chemistry. A compound: 7651-82-3, is researched, SMILESS is OC1=CC2=C(C=NC=C2)C=C1, Molecular C9H7NOJournal, Article, Bioorganic & Medicinal Chemistry Letters called Biaryl substituted hydantoin compounds as TACE inhibitors, Author is Yu, Wensheng; Tong, Ling; Kim, Seong Heon; Wong, Michael K. C.; Chen, Lei; Yang, De-Yi; Shankar, Bandarpalle B.; Lavey, Brian J.; Zhou, Guowei; Kosinski, Aneta; Rizvi, Razia; Li, Dansu; Feltz, Robert J.; Piwinski, John J.; Rosner, Kristin E.; Shih, Neng-Yang; Siddiqui, M. Arshad; Guo, Zhuyan; Orth, Peter; Shah, Himanshu; Sun, Jing; Umland, Shelby; Lundell, Daniel J.; Niu, Xiaoda; Kozlowski, Joseph A., the main research direction is biaryl hydantoin preparation TACE inhibitor SAR.Recommanded Product: 7651-82-3.

We disclose further optimization of hydantoin TNF-α convertase enzyme (TACE) inhibitors. SAR with respect to the non-prime region of TACE active site was explored. A series of biaryl substituted hydantoin compounds was shown to have sub-nanomolar K i, good rat PK, and good selectivity vs. MMP-1, -2, -3, -7, -9, and -13.

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Reference:
Chapter 1 An introduction to palladium catalysis,
Palladium/carbon catalyst regeneration and mechanical application method

Computed Properties of C10H8ClNO2. The mechanism of aromatic electrophilic substitution of aromatic heterocycles is consistent with that of benzene. Compound: 3-(2-Chlorophenyl)-5-isoxazolemethanol, is researched, Molecular C10H8ClNO2, CAS is 438565-33-4, about Synthesis of Isoxazole Moiety Containing Thieno[2,3-d]pyrimidine Derivatives and Preliminarily in vitro Anticancer Activity (Part II). Author is Yong, Jianping; Lu, Canzhong; Wu, Xiaoyuan.

New structures of isoxazole-moiety-containing thieno[2,3-d]pyrimidine derivatives I (R1 = Me, Ph; R2 = H, Me; R3 = H, Ph; R4 = H, 4-Me, 4-MeO, etc.) were synthesized for the first time and their in vitro anticancer activity against lung cancer A549, colorectal HCT116 and breast cancer MCF-7 cell lines was preliminarily evaluated using the MTT method. Most of the compounds exhibited good to excellent anticancer activity. In particular, I (R1 = Me; R2, R3 = H; R4 = Br), I (R1, R3 = Ph; R2 = H; R4 = 4-MeO) and I (R1, R3 = Ph; R2 = H; R4 = 4-Br) exhibited a broad spectrum and more potent anticancer activity against A549, HCT116 and MCF-7 cell lines, which can be regarded as the promising anticancer drug-candidates.

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Reference:
Chapter 1 An introduction to palladium catalysis,
Palladium/carbon catalyst regeneration and mechanical application method

The three-dimensional configuration of the ester heterocycle is basically the same as that of the carbocycle. Compound: 5-Hydroxynicotinic acid(SMILESS: O=C(O)C1=CN=CC(O)=C1,cas:27828-71-3) is researched.Category: quinazoline. The article 《Poly[tetraaqua(5-hydroxypyridin-1-ium-3-carboxylato-κO3)tris(μ-oxalato-κ4O1,O2:O1′,O2′)dieuropium(III)]》 in relation to this compound, is published in Acta Crystallographica, Section E: Structure Reports Online. Let’s take a look at the latest research on this compound (cas:27828-71-3).

In the title compound, [Eu2(C6H5NO3)2(C2O4)3(H2O)4]n, the EuIII atom is bonded to one O atom from a monodentate 5-hydroxypyridin-1-ium-3-carboxylate ligand, six O atoms from three oxalate ligands and two water mols., exhibiting a highly distorted tricapped trigonal geometry. Three independent oxalate ligands, each lying on an inversion center, bridge the EuIII atoms, forming a brickwall-like layer parallel to (001), which is stabilized by intralayer O-H···O hydrogen bonds. The layers are further linked through interlayer O-H···O and N-H···O hydrogen bonds and π-π interactions between the pyridine rings [centroid-centroid distance = 3.5741(14) Å] into a three-dimensional supramol. network.

From this literature《Poly[tetraaqua(5-hydroxypyridin-1-ium-3-carboxylato-κO3)tris(μ-oxalato-κ4O1,O2:O1′,O2′)dieuropium(III)]》,we know some information about this compound(27828-71-3)Electric Literature of C6H5NO3, but this is not all information, there are many literatures related to this compound(27828-71-3).

Reference:
Chapter 1 An introduction to palladium catalysis,
Palladium/carbon catalyst regeneration and mechanical application method

So far, in addition to halogen atoms, other non-metallic atoms can become part of the aromatic heterocycle, and the target ring system is still aromatic.Jerome, Francois; Monnier, Florian; Lawicka, Hania; Derien, Sylvie; Dixneuf, Pierre H. researched the compound: Chloro(1,5-cyclooctadiene)(pentamethylcyclopentadienyl)ruthenium( cas:92390-26-6 ).Formula: C18H28ClRu.They published the article 《Ruthenium catalyzed regioselective hydrophosphination of propargyl alcohols》 about this compound( cas:92390-26-6 ) in Chemical Communications (Cambridge, United Kingdom). Keywords: alkenylphosphine preparation; propargyl alc regioselective stereoselective ruthenium catalyzed hydrophosphination phenylphosphine. We’ll tell you more about this compound (cas:92390-26-6).

Catalytic hydrophosphination of propargyl alcs. by ruthenium complexes RuCl(cod)(C5Me5) and RuCl(PPh3)2(C5Me5) led to formation of functionalized vinylphosphines, with linkage of the phosphorus atom to the terminal alkyne carbon, via a ruthenium vinylidene intermediate. For example, HCC(OH)(CH3)2 reacted with Ph2PH in the presence of catalytic RuCl(cod)(C5Me5) giving Ph2PCH:CHC(OH)(CH3)2 (81% yield, Z/E = 75/25).

From this literature《Ruthenium catalyzed regioselective hydrophosphination of propargyl alcohols》,we know some information about this compound(92390-26-6)Formula: C18H28ClRu, but this is not all information, there are many literatures related to this compound(92390-26-6).

Reference:
Chapter 1 An introduction to palladium catalysis,
Palladium/carbon catalyst regeneration and mechanical application method