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1.
Tie line data of {methanol + methyl tert-butyl ether + isooctane} ternary systems were obtained at T = 303.15 K, while data for {methanol + ethylbenzene + isooctane} were taken from literature. The ternary system {methanol + methyl tert-butyl ether + ethylbenzene} and {methyl tert-butyl ether + ethylbenzene + isooctane} were completely miscible. A quaternary system {methanol + ethylbenzene + isooctane + methyl tert-butyl ether} was also studied at the same temperature. In order to obtain equilibium data of the quaternary system, four quaternary sectional planes with several methyl tert-butyl ether/methanol ratios were studied. The effect of the addition of methyl tert-butyl ether on the liquid-liquid equilibrium data of {methanol + ethylbenzene + isooctane} ternary system has been investigate at the same temperature. The distribution curves for ternary and quaternary system was analysed. For the quaternary system {methanol + ethylbenzene + isooctane + methyl tert-butyl ether}, experimental data demonstrated that the distribution coefficient of ethylbenzene between the hydrocarbon and methanol phase on a methyl tert-butyl ether–free basis slightly increases with the increase of methyl tert-butyl ether/methanol ratio. Ternary experimental results were correlated with the UNIQUAC and NRTL equation. The NRTL equation is more accurate than the UNIQUAC equation for the ternary systems studied here. The equilibrium data of three ternary systems were used for determining interactions parameters for the UNIQUAC equation. The UNIQUAC equation fitted to the experimental data appeared to be more accurate than the UNIFAC method for the same quaternary system. 相似文献
2.
Hongli Liu Tomoko Yamashita Tadashi Kamiyama Masao Fujisawa Takayoshi Kimura 《Journal of Thermal Analysis and Calorimetry》2010,99(1):95-103
The excess molar enthalpies of 8 binary mixtures for the o-, m-, and p-isomers of fluoroiodobenzene, fluoromethoxybenzene, bromofluorobenzene, chlorofluoro-benzene, difluorobenzene, fluoromethylbenzene,
fluoronitrobenzene, and aminofluoro-benzene were measured at 298.15 K. The changes of the measured enthalpies were very small.
The experimental results revealed that the isomers containing two electron-acceptor groups showed the most positive excess
enthalpy change, while isomers containing both one electron donor and one electron acceptor group, such as aminofluorobenzene,
showed more stable and always the most negative results. 相似文献
3.
Hongli Liu Satoko Kido Tadashi Kamiyama Masao Fujisawa Takayoshi Kimura 《Journal of Thermal Analysis and Calorimetry》2010,102(3):1123-1133
To obtain further systematic information for the isomer systems, the excess molar enthalpies for binary (o + m), (o + p), (m + p)-isomers of methoxymethylbenzene, ethylmethylbenzene, diethylbenzene, chloromethylbenzene, tolunitrile and fluorobenzonitrile,
tolylacetonitrile were measured at 298.15 K. In this article, the results are discussed and compared with those of previous
works. The excess enthalpies of binary systems in different solid and liquid states were measured when the pure component
of o-/m-tolunitrile, fluorobenzonitrile was titrated into the prior (o + p) or (m + p) mixtures. A series calculation for the interaction energies (IE) between the isomers was carried out for the pair molecules by ab initio MO of Gaussian 09. Correlations between the excess
enthalpies at a molar fraction of x = 0.5 and the intermolecular energy are discussed. 相似文献
4.
T. F. Ibragimov M. G. Levkovich V. A. Saprykina Kh. M. Shakhidoyatov 《Chemistry of Natural Compounds》2010,46(5):767-770
N-Chloroacetylcytisine was synthesized by acylation of (–)-cytisine. Stable Z- and E-conformers with respect to rotational isomerism around the N-12–CO bond were found in PMR spectra at room temperature. The
point at which PMR resonances of the Z- and E-conformers coalesced upon heating was measured. The transition barrier between the conformers was estimated. 相似文献
5.
Previously unknown E isomers of azomethines (Schiff bases) were synthesized from vanillal and vanillin esters by their reaction with cyclohexylamine. 相似文献
6.
(S)-Asparagine and (S)-glutamine ortho-carboranyl derivatives with free amino and carboxy groups in the α-position were synthesized. By an example of N γ-(1,2-dicarba-closo-dodecarboran-3-yl)-(S)-glutamine it was demonstrated that the developed synthetic approach carboranyl derivatives of amino acids allowed the preparation of optically pure isomers. 相似文献
7.
8.
O. G. Strukov V. B. Kondrat’ev Z. V. Vlasova V. A. Petrunin 《Russian Journal of Physical Chemistry A, Focus on Chemistry》2017,91(1):100-105
Conformers of the biologically active compounds CH3P(O)(OR)(SCH2CH2NR 2 ′ ), where (I) R = i-C4H9, R′ = C2H5 and (II) R = C2H5, R′ = i-C3H7, are calculated within the AM1 level of theory. The elongated and twisted forms with maximum and minimum distances between a nitrogen atom and those of a phosphorus tetrahedron, respectively, and bearing a syn and anti oriented alkoxy group relative to a phosphoryl oxygen, are studied. It is found that the differences between the energy, electronic, and geometric parameters of these forms are apparent in differences between their properties, e.g., the ability to participate in complexation and protonation, reactions that to some extent simulate the interaction between a substance and a biological object. 相似文献
9.
Ultra-fine fibrous mats with magnolol entrapped have been prepared by electrospinning biodegradable copolymer poly(ethylene
glycol) blocked poly(L-lactide). Drug entrapment was perfect which was confirmed by scanning electron microscopy and differential
scanning calorimetry. According to in vitro drug release investigation by high performance liquid chromatography, it was found that fibers with 10%, 20% and 30% drug
entrapped respect to polymer (mass ratio) presented dramatically different drug release behavior and degradation behavior
under the effect of proteinase K. The reason may be that fibers with 10% drug entrapped was more easily affected by enzyme
while, to some degree, magnolol in fibers with 20% and 30% entrapped prevented polymer from being degraded by enzyme. 相似文献
10.
Hong-lin Zhang Chang-qing Kong Shu-juan Yang Hong-yan Bi Jing Li 《Journal of solution chemistry》2011,40(4):632-642
The power-time curves of the micelle formation process were determined for the nonionic surfactant Tween80/nonaqueous solvent
(DMF)/long-chain alcohol (n-heptanol, n-octanol, n-nonanol, and n-decanol) systems by titration microcalorimetry at temperatures of (298.15, 303.15, 308.15, and 313.15) K. From the power-time
curves, the CMC and
DHm\uptheta\Delta H_{\mathrm{m}}^{\uptheta} values were obtained. The corresponding values of
DGm\uptheta\Delta G_{\mathrm{m}}^{\uptheta} and
DSm\uptheta\Delta S_{\mathrm{m}}^{\uptheta} were also calculated. The relationships of the CMC with the carbon number of the alcohol, the concentration of alcohol, and
the temperature, along with the thermodynamic functions, are discussed. 相似文献
11.
Hanyuan Deng 《Journal of mathematical chemistry》2008,43(1):119-133
A (n, n + 1)-graph G is a connected simple graph with n vertices and n + 1 edges. In this paper, we determine the lower bound for the Hosoya index in (n, n + 1)-graphs in terms of the order n, and characterize the (n, n + 1)-graph with the smallest Hosoya index. 相似文献
12.
D. A. Köse G. Gökçe S. Gökçe İ. Uzun 《Journal of Thermal Analysis and Calorimetry》2009,95(1):247-251
Three novel mixed ligand complexes of Ni(II), Zn(II) and Cd(II) with p-chlorobenzote and N,N-diethylnicotinamide were synthesised and characterized on the basis of elemental analysis, FTIR spectroscopic
analysis, solid state UV-Vis spectrometric and magnetic susceptibility data. The thermal behavior of the complexes was studied
by simultaneous TG-DTA methods in static air atmosphere and the mass spectra data were recorded.
According to microanalytical results, formulas of complexes are C34H40N4O8ClNi, C34H40N4O8ClZn and C34H44N4O10ClCd. The complexes contain two moles of coordination waters, two moles p-chlorobenzoate and two mole N,N-diethylnicotinamide (dena) ligands per formula unit. In these complexes, the p-chlorobenzoate and N,N-diethylnicotinamide behave as monodentate ligand through acidic oxygen and nitrogen of pyridine ring.
The decomposition pathways and the stability of the complexes are interpreted in the terms of the structural data. The final
decomposition products were found to be as metal oxides. 相似文献
13.
R. N. Shakhmaev A. Sh. Sunagatullina D. A. Akimova V. V. Zorin 《Russian Journal of Organic Chemistry》2017,53(4):615-617
An efficient synthetic approach to 2E,4E and 2E,4Z isomers of ethyl 5-chloropenta-2,4-dienoate has been developed on the basis of one-pot oxidation–olefination of readily accessible (E)- and (Z)-3-chloroprop-2-en-1-ols by the action of barium manganate and ethyl (triphenyl-λ5-phosphanylidene)acetate. 相似文献
14.
E. A. Dikusar V. I. Potkin D. A. Rudakov T. D. Zvereva S. K. Petkevich M. M. Ogorodnikova A. P. Yuvchenko M. P. Bei 《Russian Journal of General Chemistry》2012,82(3):413-416
A method of preparative synthesis of o(m)-carborane-containing azomethines via the condensation of o(m)-carboranyl-C-methylene-4-formylbenzoates with aliphatic, cycloaliphatic, and aromatic amines was developed. 相似文献
15.
A. V. Lezov G. E. Polushina A. A. Lezov P. S. Vlasov N. S. Domnina 《Polymer Science Series A》2011,53(2):93-101
The hydrodynamic and conformational properties of molecules of poly(N,N-diallyl-N,N-dimethylammonium chloride) and N,N-diallyl-N,N-dimethylammonium chloride-maleic acid copolymers of different compositions in solutions with various ionic-strength and pH
values, as well as of the polyelectrolyte complex based on the copolymer with dodecyl sulfate anions in chloroform, are studied.
For poly(N,N-diallyl-N,N-dimethylammonium chloride) molecules in a 1 M NaCl solution, the Kuhn segment length and the hydrodynamic diameter of the
chain are estimated as A = 3.9 nm and d = 0.48 nm, respectively. In acidic solutions with pH 3.5, the copolymers demonstrate behavior typical for polyelectrolytes.
In an alkaline solution with pH 13, when 1 M NaCl is added to the solution of the copolymer containing 29 mol % maleic acid
units, there is an antipolyelectrolyte effect that manifests itself as an increase in the intrinsic viscosity of the copolymer
and in the hydrodynamic radius of its molecules. It is found that an increase in the fraction of maleic acid units in the
copolymer from 12 to 42 mol % brings about a reduction in the equilibrium rigidity of its macromolecules from 4.1 to 2.2 nm.
The equilibrium rigidity of polyelectrolyte-complex molecules is higher than that of initial copolymer molecules owing to
steric interactions arising between the aliphatic chains of dodecyl sulfate anions. In an electric field, the molecules of
the complex are oriented owing to the induced dipole moment resulting from the displacement of dodecyl sulfate anions along
the chain contour. 相似文献
16.
A number of (Z)-N,N-dialkyl- and (Z)-N-acyl-N-alkyl-O-methylnicotinamide oximes was synthesized. Their configuration was confirmed by the NOESY experiment. Evaluation of fungicidal
activity of compounds obtained was performed. 相似文献
17.
A. I. Vorob’eva M. S. Babaev L. V. Spirikhin N. M. Shishlov S. V. Kolesov 《Russian Journal of Applied Chemistry》2016,89(1):160-164
A copolymer of N,N-diallyl-N,N-dimethylammonium chloride with maleic acid of constant composition was prepared under the conditions of radical initiation. The possibility of the functionalization of the copolymer with drugs containing amino groups by polymer-analogous transformations was examined. Conditions were found for preparing conjugates of the copolymer with isoniazid. The structures and the quantitative compositions of the conjugates were determined by 13С NMR spectroscopy, and the possibility of preparing conjugates with controlled drug content was demonstrated. 相似文献
18.
19.
M. V. Musalova A. G. Khabibulina V. A. Potapov S. V. Amosova 《Russian Journal of Organic Chemistry》2017,53(10):1593-1595
A procedure for the stereoselective synthesis of dichloro[(Z)-2-chloro-2-phenylethenyl][(4E)-5- chlorooct-4-en-4-yl]-λ4-tellane and [(Z)-2-chloro-2-phenylethenyl][(4E)-5-chlorooct-4-en-4-yl]tellane has been developed on the basis of anti-addition of tellurium tetrachloride–phenylacetylene monoadduct to oct-4-yne. 相似文献
20.
S. M. Rasulov A. R. Rasulov 《Russian Journal of Physical Chemistry A, Focus on Chemistry》2009,83(5):756-759
The pVT properties of the 0.075 n-C5H12 + 0.925H2O binary system were studied experimentally. Thermal properties were measured along nine different isochores over the density and temperature ranges 87–698 kg/m3 and 303–684 K at pressures up to 60 MPa. Measurements were performed using a constant-volume piezometer. Inflection and break points of the p(T) dependences were used to construct phase equilibrium curves, which were described by scaling equations. 相似文献