Search results for "Benzene"
showing 10 items of 1701 documents
Dimeric capsules of tetraurea calix[4]arenes. MD simulations and X-ray structure, a comparison
2002
The single crystal X-ray structure of a homodimer of a tetra(tolylurea) calix[4]arene including a tetraethylammonium cation as guest shows an expansion of the capsule and a distortion of its shape, in comparison to the structure of a similar dimer with an encapsulated benzene molecule. Thus, only 8 of 16 possible hydrogen bonds are present in the hydrogen bonded belt holding together the two hemispheres. The encapsulated cation is disordered over two equivalent positions with two methyl groups pointing to the equator, while two methyl groups pointing to the poles form CH–π interactions with the inner surfaces of the calixarene cavities. MD simulations are in agreement with the distorted X-r…
Structure-reactivity relationship for aromatics transalkylation and isomerization process with TNU-9, MCM-22 and ZSM-5 zeolites, and their industrial…
2011
[EN] TNU-9 is a medium pore zeolite with a complex tridimensional channel system. Its catalytic properties have been studied in some reactions that involve the BTX fraction, such as benzene and toluene alkylation with methanol, ethanol or isopropanol. These reactions use in practice medium pore zeolites such as ZSM-5 (MFI) or MCM-22 (MWW), and the selectivities obtained with TNU-9 are compared and analyzed from the point of view of the zeolite structure and pore topology, as well as from its possible industrial application. For benzene alkylation to give ethylbenzene (EB), TNU-9 is an active and selective catalyst with selectivities to EB much higher than ZSM-5 and close to those of the ind…
Influence of Pore-Volume Topology of Zeolite ITQ-7 in Alkylation and Isomerization of Aromatic Compounds
2002
The void structure of zeolite ITQ-7 (ISV structure) is discussed on the basis of catalytic reaction tests. The isomerization and disproportionation of meta-xylene, and the alkylation of benzene or toluene with either ethanol or isopropanol, on the acidic zeolite have been used as model reactions. The dimensions of its three-dimensional system of channels, with pores between 6.1 and 6.3 A and with lower tortuosity than those of beta zeolite, favor higher ratios of isomerization to disproportionation of meta-xylene, and of mono- to dialkylated products and iso- to n-propylbenzene during alkylation of benzene. These effects are enhanced with a partially coked ITQ-7.
The possibilities of using broadleaf cattail seeds (Typha latifolia L.) as super absorbents for removing aromatic hydrocarbons (BTEX) from an aqueous…
2018
Sorption of oil-related products (including mainly the propellants) is the very basic process that counteracts spreading these types of pollution into environment. Plenty of synthetic substances (including the monoaromatic hydrocarbons) are both from the surface and underground waters. The aim of this study was to present the research’s results on the possibilities of using the broadleaf cattail (Typha latifolia L.) seeds as a sorbent of monoaromatic hydrocarbons from an aqueous solution. In order to increase sorptive capacity, the seeds biomass was submitted for the process of mercerizing in diversified time and temperature in water and the NaOH solution. The removal of benzene, toluene, e…
Nachweis des di-2-cyanoisopropylperoxides bei der zersetzung von azoisobuttersäuredinitril in gegenwart von sauerstoff
1970
Das Di-2-cyanoisopropylperoxid entsteht in etwa 5-proz. Ausbeute bei der Zersetzung von Azoisobuttersaredinitril unter Sauerstoff in Isobutyronitril als Losungsmittel. Thermisch zerfallt das Peroxid est oberhalb von 120°C mit mesbarer Geschwindigkeit in einer Reaktion erster Ordnung. Die Aktivierungsenergie, in Cumol als Losungsmittel, wurde zu 37,9 kcal · mol−1 bestimmt. Werte fur die Zerfallskonstante bei 140°C sind in Cumol 0,057 h−1, in tert-Butylbenzol 0,073 h−1, in Chlorbenzol 0,18 h−1 und in o-Dichlorbenzol 0,23 h−1. Di-2-cyanoisopropylperoxide is formed when azobisisobutyronitrile is decomposed under oxygen in isobutyronitrile as a solvent. The yield amounts to ca. 5%. Thermal decom…
Xylene isomerization and aromatic alkylation in zeolites NU-87, SSZ-33, β, and ZSM-5: molecular dynamics and catalytic studies
2004
The unique pore topology of zeolite NU-87, with 10-membered ring (MR) channels intersected by perpendicular 12-MR cavities, can offer new opportunities for alkylaromatics isomerization, as well as for aromatics alkylation. The catalytic performance has been studied for meta-xylene isomerization and disproportionation, as well as toluene alkylation with methanol, ethanol, propanol, and isopropanol. Product distribution was interpreted on the basis of pore topology and compared to zeolites with 12-MR (β), 10- and 12-MR (SSZ-33), and 10-MR (ZSM-5) zeolites. The presence of cavities allows more space for the location of bulky intermediates and/or products, and also traps the molecules, allowing…
New insights on the electronic, magnetic, electric and molecular structure of a bis-(4-cyanopyridine) iron(III) complex with the meso-tetrakis(4-meth…
2019
International audience; We have successfully synthesized and characterized a new low-spin iron(III) bis(4-cyanopyridine) complex with a meso-porphyrin substituted in the para positions of the phenyls by the methoxy group, namely the bis(4-cyanopyridine)[(meso-tetrakis(4-metoxyphenylporphyrinato)]iron(III) trifluoromethanesulfonate chlorobenzene monosolvate complex with the formula [FeIII(TMPP)(4-CNpy)2]SO3CF3.C6H5Cl (I). This species was characterized through ultraviolet–visible, Fourier-transform infrared and Mössbauer spectroscopy as well as by SQUID magnetometry, cyclic voltammetry, and X-ray crystallography. These characterizations indicated that our synthetic heme model is a low-spin (…
Synthesis, spectroscopic, cyclic voltammetry properties and molecular structure of the thiocyanato-N meso-tetratolylporphyrinato zinc(II) ion complex
2017
International audience; This paper describes the synthesis of the (thiocyanato-N)(meso-tetratolylporphyrinato)zinc(II) chlorobenzene monosolvate complex with the formula [K(2,2,2-crypt)][Zn(TTP)(NCS)]·C6H5Cl (I) using the cryptand-222 to solubilize potassium thiocyanate in chlorobenzene solvent. Complex (I) has been characterized by elementary analysis, IR, UV–vis, 1H NMR and MS, and the structure of this new zinc(II) metalloporphyrin been examined crystallographically. A cyclic voltammetry investigation was also carried out on this species. The title compound crystallizes in the triclinic, space group P-1, with a = 11.5151(7) Å, b = 15.212(10) Å, c = 20.1093(12) Å, α = 80.428(4)°, β = 74.9…
From Hexaphenylbenzene to 1,2,3,4,5,6-Hexacyclohexylcyclohexane
2020
The hydrogenation of hexaphenylbenzene was studied, affording novel partially hydrogenated hexacyclohexylbenzene (HCB) as well as fully hydrogenated 1,2,3,4,5,6-hexacyclohexylcyclohexane (HCC) as an unprecedented “oligocyclohexyl” molecule. The reaction process was analyzed by mass spectrometry with atmospheric pressure chemical ionization and high-performance liquid chromatography. From a crude product mixture, two different crystals with flake- and block-shapes could be grown and analyzed by X-ray crystallography, revealing their structures as HCB and HCC. While a geared arrangement of cyclohexyl substitutes was found in HCB, two isomeric structures were identified in HCC crystal with cha…
T-T cell interactions during in vitro cytotoxic T lymphocyte responses. III. Antigen-specific T helper cells release nonspecific mediator(s) able to …
1980
T helper cell induction and the specificity of T cell-mediated help as generated during alloreactive and H-2-restricted, virus- or hapten-specific cytotoxic T lymphocyte (CTL) responses have been compared. With the use of a double-chamber culture system, it was possible to dissect and separately analyze the induction phase of T helper cells from the T helper cell effector function. The data obtained revealed that during alloreactive as well as H-2-restricted T cell responses, antigen-specific T helper cells are induced. Upon specific restimulation of T helper cells, helper cell function is mediated across a cell-impermeable membrane via soluble products in an apparently nonspecific and nonr…