Measurement and modeling of clemastine fumarate (antihistamine drug) solubility in supercritical carbon dioxide

The solubilities of clemastine fumarate in supercritical carbon dioxide (ScCO2) were measured for the first time at temperature (308 to 338 K) and pressure (12 to 27 MPa). The measured solubilities were reported in terms of mole faction (mol/mol total) and it had a range from 1.61 × 10–6 to 9.41 × 10–6. Various models were used to correlate the data. The efficacy of the models was quantified with corrected Akaike’s information criterion (AICc). A new cluster salvation model was derived to correlate the solubility data. The new model was able to correlate the data and deviation was 10.3% in terms of average absolute relative deviation (AARD). Furthermore, the measured solubilities were also correlated with existing K.-W. Chen et al., model, equation of state model and a few other density models. Among density models, Reddy and Garlapati model was observed to be the best model and corresponding AARD was 7.57% (corresponding AICc was − 678.88). The temperature independent Peng–Robinson equation of state was able to correlate the data and AARD was 8.25% (corresponding AICc was − 674.88). Thermodynamic parameters like heats of reaction, sublimation and solvation of clemastine fumarate were calculated and reported.

Study on Indium (III) Oxide/Aluminum Thermite Energetic Composites

Thermites or composite energetic materials are mixtures made of fuel and oxidizer particles at micron-scale. Thermite reactions are characterized by high adiabatic flame temperatures (>1000 °C) and high heats of reaction (>kJ/cm3), sometimes combined with gas generation. These properties strongly depend on the chemical nature of the couple of components implemented. The present work focuses on the use of indium (III) oxide nanoparticles as oxidizer in the elaboration of nanothermites. Mixed with an aluminum nanopowder, heat of reaction of the resulting Al/In2O3 energetic nanocomposite was calculated and its reactive performance (sensitivity thresholds regarding different stimuli (impact, friction, and electrostatic discharge) and combustion velocity examined. The Al/In2O3 nanothermite, whose heat of reaction was determined of about 11.75 kJ/cm3, was defined as insensitive and moderately sensitive to impact and friction stimuli and extreme sensitive to spark with values >100 N, 324 N, and 0.31 mJ, respectively. The spark sensitivity was decreased by increasing In2O3 oxidizer (27.71 mJ). The combustion speed in confined geometries experiments was established near 500 m/s. The nature of the oxidizer implemented herein within a thermite formulation is reported for the first time.

Three Important Refinements of the Condensed Matter Detonation Theory

Some sections of the theory of shock-wave processes in condensed media require substantial refinement. From a detailed analysis of the concept of heat of reaction, it follows that the three known heats of reaction characterize the same transformation of the reacting medium from three different sides. When considering the flows of a reacting medium, it is necessary to take into account turbulence and its changes as an analogue of thermal motion and physicochemical transformations of matter. Based on the analysis of the results of a unique experiment, it was concluded that the deformation of the condensed medium is a factor that determines the reaction rate along with temperature.

Synergy Effects in the Chemical Synthesis and Extensions of Multicomponent Reactions (MCRs)—The Low Energy Way to Ultra-Short Syntheses of Tailor-Made Molecules

Synergistic effects between reactions, reagents and catalysts can lead to minor heats of reaction and occur as an inherent result of multi-component reactions (MCRs) and their extensions. They enable syntheses to be performed at a low energy level and the number of synthesis steps to be drastically reduced in comparison with ‘classical’ two-component reactions. The very high potential for variability, diversity and complexity of MCRs additionally generates an extremely diverse range of products, thus bringing us closer to the aim of being able to produce tailor-made and extremely low-priced materials, drugs and libraries.