4389-09-7Relevant academic research and scientific papers
Thermal reduction of 7H-benz[d,e]anthracen-7-one and related ketones under hydrogen-transfer conditions
Mulder,Hemmink,De Heer,Lupo,Santoro,Korth
, p. 6611 - 6619 (2007/10/03)
In the presence of hydrogen donor solvents and at elevated temperatures, aromatic ketones can be selectively deoxygenated to the corresponding hydroaromatic compounds. The kinetics for reduction of 7H-benz[d,e]anthracen-7-one (benzanthrone, 6) into 7H-benz[d,e]anthracene (benzanthrene, 1) in 9,10-dihydroanthracene (3) solvent has been investigated in detail. The relatively slow hydrogenation of 6 is due to reversibility of the initial hydrogen-transfer step according to a reverse radical disproportionation (RRD). The dynamics could well be rationalized using the energetics of species computed by density functional theory (DFT). The application of hydrogen donors such as 1 as a hydrogen-transfer agent, although favorable in terms of a low benzylic carbon-hydrogen bond dissociation enthalpy, is limited due to the slow self-hydrogenation, which in case of 1 gives 5,6-dihydro-4H-benz[d,e]anthracene (7).
Characterization of polycyclic aromatic hydrocarbon particulate and gaseous emissions from polystyrene combustion
Durlak, Susan K.,Biswas, Pratim,Shi, Jichun,Bernhard, Mary Jo
, p. 2301 - 2307 (2007/10/03)
The partitioning of polycyclic aromatic hydrocarbons (PAHs) between the particulate and gaseous phases resulting from the combustion of polystyrene was studied. A vertical tubular flow furnace was used to incinerate polystyrene spheres (100-300 μm) at different combustion temperatures (800- 1200 °C) to determine the effect of temperature and polystyrene feed size on the particulate and gaseous emissions and their chemical composition. The furnace reactor exhaust was sampled using real-time instruments (differential mobility particle sizer and/or optical particle counter) to determine the particle size distribution. For chemical composition analyses, the particles were either collected on Teflon filters or split into eight size fractions using a cascade impactor with filter media substrates, while the gaseous products were collected on XAD-2 adsorbent. Gas chromatography/mass spectroscopy (GC/MS) was used to identify and quantify the specific PAH species, their partitioning between the gas and particulate phases, and their distribution as a function of emission particle size. The total mass and number of PAH species in both the particulate and gas phases were found to decrease with increasing incineration temperature and decreasing polystyrene feed size, while the mean diameter of the particles increases with increasing incineration temperature and decreasing feed size. In addition, the PAH species in the particulate phase were found to be concentrated in the smaller aerosol sizes. The experimental results have been analyzed to elucidate the formation mechanisms of PAHs and particles during polystyrene combustion. The implications of these results are also discussed with respect to the control of PAH emissions from municipal waste-to-energy incineration systems. The partitioning of polycyclic aromatic hydrocarbons (PAHs) between particulate and gaseous phases resulting from the combustion of polystyrene was studied. A vertical tubular flow furnace was used to incinerate polystyrene spheres to determine the effect of temperature and polystyrene feed size on the particulate and gaseous emissions and their chemical composition. The furnace reactor exhaust was sampled using real-time instruments to determine the particle size distribution. The total mass and number of PAH species in both the particulate and gas phases were found to decrease with increasing incineration temperature and decreasing polystyrene feed size, while the mean diameter of the particles increases with increasing incineration temperature and decreasing feed size. In addition, the PAH species in the particulate phase were found to be concentrated in the smaller aerosol sizes.
