Day: August 23, 2021

Computed Properties of https://www.ambeed.com/products/93-03-8.html, Chemistry graduates have much scope to use their knowledge in a range of research sectors, including roles within chemical engineering, chemical and related industries, healthcare and more.93-03-8, Name is (3,4-Dimethoxyphenyl)methanol, SMILES is OCC1=CC=C(OC)C(OC)=C1, belongs to thiomorpholine compound. In a article, author is Starosta, Radoslaw, introduce new discover of the category.

The copper(I) iodide or copper(I) isothiocyanate complexes with 2,9-dimethyl-1,10-phenanthroline (dmp) and two interesting aminomethylphosphanes: P(CH2N(CH2CH2)(2)O)(3) (1) and novel P(CH2N(CH2CH2)(2)S)(3) (2): CuI(dmp)P(CH2N(CH2CH2)(2)O)(3) (1I), which was presented in our previous papers, CuI(dmp)P(CH2N(CH2CH2)(2)S)(3) (2I), CuNCS(dmp)P(CH2N(CH2CH2)(2)O)(3) (1T) and CuNCS(dmp)P(CH2N(CH2CH2)(2)S)(3) (2T) are discussed in this work. The chemical structures of three new complexes were determined in solution by means of NMR spectroscopy and in solid state using X-ray measurements. For all presented complexes the coordination geometry about the Cu(I) centre is pseudo-tetrahedral showing the small flattening and large rocking distortions. All compounds crystallize as the discrete dimers bound by pi-stacking interactions between dmp rings, which strongly depend on the phosphane ligand. Investigated complexes exhibit orange photoluminescence in the solid state of highly diversified intensity, position of the luminescence band and the lifetimes. On the basis of TDDFT calculations, the CT bands observed in UV-Vis spectra are assigned to the two mixed transitions from the CuX (X = I or NCS) bond with a small admixture of the CuP bond to pi* orbitals of the dmp ligand: (MX,MPR3)LCT. However, emission bands can be interpreted to be of (MX)LCT type.

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Reference:
Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem

In chemical reaction engineering, simulations are useful for investigating and optimizing a particular reaction process or system. In an article, author is Sovilj, SP, once mentioned the application of 104-21-2, Name is 4-Methoxybenzyl acetate, molecular formula is C10H12O3, molecular weight is 180.2, MDL number is MFCD00038509, category is thiomorpholine. Now introduce a scientific discovery about this category, Electric Literature of 104-21-2.

Five new Cu-II complexes of general formula [Cu-2(Rdtc)tpmc](ClO4)(3), (1)-(5), where tpmc and Rdtc(-) refer to N,N’,N,N’-tetrakis(2-pyridylmethyl)-1,4,8,11-teraazacyclotetradecane and piperidine- (Pipdtc), 4-morpholine-(Morphdtc), 4-thiomorpholine- (Timdtc), piperazine- (Pzdtc) or N-methylpiperazine- (N-Mepzdtc) dithiocarbamates, respectively, have been prepared. Elemental analyses, conductometric and magnetic measurements, u.v./vis, i.r., e.p.r. and mass spectroscopy have been employed to characterize them. The complexes adopt an exo coordination of CuII ions and tpmc. The dithiocarbamate ion joins both the sulphur and the copper atoms acting as a bridging ligand The presence of different heteroatoms in the piperidine ring influences the nu(Cdouble bondN) and nu(Cdouble bondS) vibrations which decrease in the order of the complexes: Pipdtc > N-Mepipdtc > Pzdtc > Morphdtc > Timdtc ligands. Attention has been paid to the detailed mechanism of the mass spectral fragmentation of the complexes. The g(eff) factors of the complexes have been also estimated by e.p.r. spectra. Finally, the complexes obtained demonstrate microbiologycal activity against some bacteria.

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Reference:
Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem

Chemical engineers work across a number of sectors, but chemistry and chemical engineering roles are found throughout, creation and manufacturing process of chemical products and materials. In an article, author is Ghorab, M. M., once mentioned the application of 14470-28-1, Name is (Chloro(4-methoxyphenyl)methylene)dibenzene, molecular formula is C20H17ClO, molecular weight is 308.8014, MDL number is MFCD00000814, category is thiomorpholine. Now introduce a scientific discovery about this category, Recommanded Product: 14470-28-1.

Interaction of dapson [bis(4-aminophenyl)sulfone] 1 with [bis-(methylsulfonyl) methylidine]malononitrile 2 yielded the corresponding dicyano derivative 3, which was reacted with acetic anhydride, succinic anhydride, 4-chlorobenzaldehyde, phenyl isothiocyanate to give the corresponding acetamide 4, succinamic acid 5, pyrrolidine 6, Shiff base 7 and thiourea 8, respectively. Treatment of 3 with chloroacetyl chloride afforded the aminoacetyl chloride derivative 9. Further, the interaction of compound 9 with thioglycolic acid, malononitrile, ethyl glycinate hydrochloride, and/or potassium thiocyanate furnished compounds 10-15, respectively. The structural characterization of the prepared compounds was based on microanalytical and spectroscopic analyses. Some of the prepared compounds were tested for their antimicrobial and antitumor activities. Compounds 9 and 12 showed promising antitumor activity compared with Doxorubicin as positive control.

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Reference:
Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem

Healthcare careers for chemists are once again largely based in laboratories, although increasingly there is opportunity to work at the point of care, helping with patient investigation. 30379-55-6, Name is 2-(Benzyloxy)acetic acid, molecular formurla is C9H10O3. In a document, author is Blizzard, Timothy A., introducing its new discovery. Related Products of 30379-55-6.

Thrombin is a serine protease that plays a key role in blood clotting. Pyrrolidine 1 is a potent thrombin inhibitor discovered at Merck several years ago. Seven analogs (2-8) of 1 in which the pyrrolidine core was replaced with various heterocycles were prepared and evaluated for activity against thrombin, clotting factors VIIa, IXa, Xa, and XIIa, and trypsin. The thiomorpholine analog 6 was the most active, essentially matching the thrombin inhibitory activity of 1 with slightly improved selectivity over trypsin. (C) 2014 Elsevier Ltd. All rights reserved.

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Reference:
Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem

In chemical reaction engineering, simulations are useful for investigating and optimizing a particular reaction process or system. In an article, author is Carriedo, Gabino A., once mentioned the application of 101-20-2, Name is 1-(4-Chlorophenyl)-3-(3,4-dichlorophenyl)urea, molecular formula is C13H9Cl3N2O, molecular weight is 315.5824, MDL number is MFCD00013254, category is thiomorpholine. Now introduce a scientific discovery about this category, Name: 1-(4-Chlorophenyl)-3-(3,4-dichlorophenyl)urea.

The reaction of poly(dichlorophosphazene) [NPCl2](n), with 2,2′-dihydroxybiphenyl, 2,2′-(OH)C6H4-C6H4(OH), and then with p-anisidine, p-NH2C6H4OMe, in the presence of K2CO3 led to the formation of the chlorine containing phosphazene copolymer {[Np(O2C12H8)](0.75)[NP(NHC6H4OMe)(2)](0.15)[NP(NHC6H4OMe)Cl](0.05)[NPCl2](0.05)}(n), (1), which could be isolated and fully characterised. When using cyclic secondary amines instead of aromatic primary amines, namely, HNC5H10 (piperidine), HNC4H8O (morpholine), HNC4H8S (thiomorpholine), the reaction gave the functionalized copolymers {[NP(O2C12H8)(10.6)[NP(NC5-H-10)(2)](0.35), (2) IINP(O2Cl2H8)](0.65)[NP(NC4H8O)(2)](0.35)}(n), (3) and {[NP(O2Cl2H8)](0.75)[NP(NC4H8S)(2)](0.25)}(n), (4), respectively. The broad bands in their P-31 NMR spectra and the bimodal aspect of their GPC chromatograms suggested they could be forming aggregates in solution. (c) 2006 Elsevier Ltd. All rights reserved.

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Reference:
Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem

Healthcare careers for chemists are once again largely based in laboratories, although increasingly there is opportunity to work at the point of care, helping with patient investigation. 2471-70-7, Name is 6-Methoxy-2-naphthoic acid, molecular formurla is C12H10O3. In a document, author is Morkved, Eva H., introducing its new discovery. Reference of 2471-70-7.

The Zn(quinoline)(2)Cl-2 complex is found to be a convenient reagent for the direct synthesis of amino-substituted, zinc azaphthalocyanines. Octa(4-thiomorpholinyl)- and octa(1-pyrazolyl)- substituted zinc azaphthalocyanines were synthesized from pyrazines, 5,6-bis(4-thiomorpholinyl)pyrazine-2,3-dicarbonitrile and 5,6-bis(1-pyrazolyl)pyrazine-2,3-dicarbonitrile, respectively and dry Zn(quinoline)(2)Cl-2. Two zinc azaphthalocyanines, both mixtures of four constitutional isomers, were synthesized by the same method, from 6-(2-thienyl)-5-(4-thiomorpholinyl)pyrazine-2,3-dicarbonitrile and from 6-(2-thienyl)-5-(1-pyrazolyl)pyrazine-2,3-dicarbonitrile respectively. The octa(4-thiomorpholinyl)- and octa(1-pyrazolyl)-substituted zinc azaphthalocyanines and the zinc azaphthalocyanines with mixed substituents were characterized by elemental analyses, TOF-SIMS, H-1 and C-13 NMR, and UV-vis spectroscopic methods. Q-bands for octa(4-thiomorpholinyl)- and octa(I-pyrazolyl)-substituted zinc azaphthalocyanines and the zinc azaphthalocyanines with mixed substituents are found at respectively 655 and 670 nm (epsilon: 100 000-180 000 M-1.cm(-1)). Copyright (c) 2006 Society of Porphyrins & Phthalocyanines.

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Reference:
Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem

Modeling chemical reactions helps engineers virtually understand the chemistry, optimal size and design of the system, and how it interacts with other physics that may come into play. In an article, author is Babic-Samardija, K., once mentioned the application of 3886-70-2, Name is (R)-1-(Naphthalen-1-yl)ethanamine, molecular formula is C12H13N, molecular weight is 171.2383, MDL number is MFCD00064114, category is thiomorpholine. Now introduce a scientific discovery about this category, Safety of (R)-1-(Naphthalen-1-yl)ethanamine.

Four mixed-ligand cobalt(III) complexes (1-4) of the general formula [Co(Rdtc)cyclam](ClO4)(2) and [Co(Rac)cyclam](ClO4)(2) (cyclam = 1,4,8,11-tetraazacyclotetradecane; Rdtc = thiomorpholine-(Timdtc) or 2-methylpiperidine-(2-Mepipdtc) dithiocarbamates; Rac = 1,1,1,5,5,5-hexafluoro-2,4-pentanedionato (Hfac) or 2,2,6,6-tetramethyl-3,5-heptanedionato (Tmhd), respectively) were electrochemically examined on a glassy carbon and an iron electrode in perchloric acid solution. The obtained results showed the influence of these complexes on hydrogen evolution, the oxygen reduction reaction and iron dissolution. The exhibited effects of the complexes on these reactions depend on structure related to the bidentate dithiocarbamato or beta-diketonato ligand. The electrochemical properties of the complexes were correlated with molecular structure and parameters derived from spectral analysis and molecular modeling.

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Reference:
Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem

Formula: https://www.ambeed.com/products/119-47-1.html, Career opportunities within science and technology are seeing unprecedented growth across the world, and those who study chemistry or another natural science at university now have increasingly better career prospects.119-47-1, Name is 2,2-Methylenebis(6-tert-butyl-p-cresol), SMILES is OC1=C(CC2=C(O)C(C(C)(C)C)=CC(C)=C2)C=C(C)C=C1C(C)(C)C, belongs to thiomorpholine compound. In a article, author is Gischig, S, introduce new discover of the category.

The synthesis of the ligand precursor 1,3-bis{(R)-1-[(S)-2(diphenylphosphanyl)ferrocenyl]ethyl}imidazolium iodide ([PCPH]I,1) was extended to the electronically and sterically modified ligand precursors 1,3-bis{(R)-1-[(S)-2-{[3,5-bis(tri- fluoromethyl) phenyl] phosphanyl}ferrocenyl] ethyl}imidazolium iodide ([3,5-CF3-PCPH]I, 6), and 1,3-bis[(R)-1-{(S)-2[bis(3,5-dimethylphenyl)phosphanyl)ferrocenyl}ethyl]imidazolium iodide ([3,5-Me-PCPH]I, 7). Palladium complexes were prepared starting from [Pd(OAc)(2)](3) in THF to afford [PdI(PCP)]OAc (8), [Pd(OAc)(3,5-CF3-PCP)]I (9), and [PdI(3,5-Me-PCP)]OAc (10), in excellent yields. The crystal structures of the ligand precursor [3,5-CF3-PCPH]I (6), the complex [PdI(3,5-CF3-PCP)]PF6 (14), as well as the dicationic complex [Pd(NCCH3)(PCP)](PF6)(2) (11), were determined by X-ray diffraction. Complex 11 and its derivative [Pd(NCCH3)(3,5-Me-PCP)](PF6)(2) (13) have been tested as catalysts in the asymmetric addition of, for example, thiomorpholine to methacrylonitrile giving selectivities up to 63 and 75 % ee, respectively, at -80 degrees C. ((c) Wiley-VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2005).

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Reference:
Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem

In chemical reaction engineering, simulations are useful for investigating and optimizing a particular reaction process or system. In an article, author is Yadav, Manoj K., once mentioned the application of 615-37-2, Name is 1-Iodo-2-methylbenzene, molecular formula is C7H7I, molecular weight is 218.035, MDL number is MFCD00001042, category is thiomorpholine. Now introduce a scientific discovery about this category, Electric Literature of 615-37-2.

New dithiocarbamate (dtc) complexes of the form [(PhHg)(2)L] (L = bis(furfurylaminomethyl)benzene dtc L1 (1)), [PhHg(L)] (L = ethyl-1-piperazinecarboxylate dtc L2 (2), thiomorpholine dtc L3 (3), N-(N-methyl-2-pyrrole)-N-(methyl-3-pyridyl) dtc L4 (4), N-(N’-methyl-2-pyrrole)-N-(methyl-benzyl) dtc L5 (5)) and [Hg(L)(2)] (L = bis(N-methyl-3-pyridyl) dtc L6 (6), L4 (7), L5 (8)) have been synthesized and fully characterised; their structures revealed by X-ray crystallography. 1-5 show similar structures with the metal atoms forming two strong bonds, to carbon and one sulfur atom from the bidentate ligand in an approximate linear arrangement with an additional weak bond to the second sulfur atom. However the complexes show very different packing arrangements. 1 is a less common type of dinuclear organomercury complex containing two dithiocarbamate units linked by a 1,4-dibenzyl group. In 6, the metal lies at the centre of a distorted square plane coordinated by two L6 ligands, axially bonded by sulfur atoms on the adjacent molecules in a 2-D polymeric chain. In 7 and 8 the Hg atom is tetrahedrally coordinated to four sulfur atoms from two bidentate ligands. Complexes 2, 5, 7 and 8 show luminescence in solution. (C) 2014 Elsevier B.V. All rights reserved.

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Reference:
Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem

Healthcare careers for chemists are once again largely based in laboratories, although increasingly there is opportunity to work at the point of care, helping with patient investigation. 76-83-5, Name is (Chloromethanetriyl)tribenzene, molecular formurla is C19H15Cl. In a document, author is Wei, Wen-Juan, introducing its new discovery. Synthetic Route of 76-83-5.

We have successfully synthesized a new antimony-based halide hydrate, bis(thiomorpholine) pentachloroantimonate(III) monohydrate (C4NSH10)(2)[SbCl5]center dot H2O (1, C4NSH10+ is thiomorpholine cation), which crystals in a centrosymmetric space group of Pbca. 1 features the R2MX5-type perovskite architecture and undergoes a first-order structural phase transition (PT) at 406.3 K, accompanying with prominent dielectric responses. The photoluminescence spectra reveal that 1 shows a broadband light emission and a long lifetime (2.77 mu s). In addition, the DFT calculation exhibits the organic thiomorpholine cation has a contribution to electronic band structures of 1, which is distinct with other halide bismuth (Bi) and antimony (Sb)-based hybrid perovskites. This finding opens up a potential pathway to construct new lead-free hybrid materials for application of the optoelectronics. (C) 2020 Elsevier B.V. All rights reserved.

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Reference:
Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem