Search results for "Thioxanthone"
showing 6 items of 6 documents
Comprehensive analysis of photoinitiators and primary aromatic amines in food contact materials using liquid chromatography High-Resolution Mass Spec…
2018
Abstract A comprehensive strategy for the analysis of UV-ink photoinitiators and primary aromatic amines (PAAS) in food-packaging materials such as, juice tetrabricks, pouches and bags has been developed using liquid chromatography coupled to Orbitrap High-Resolution Mass Spectrometry (LC-Orbitrap-HRMS). The methodology includes both quantitative target analysis and post-run target screening analysis. The quantitative method was validated after a previous optimisation of the single-stage Orbitrap fragmentation through the Higher-Energy Collisional Dissociation (HCD) Cell. Overall, the quantitative method presented recoveries ranging from 78% to 119%, with a precision (RSD) lower than 20%, f…
Principes généraux d'évaluation/gestion du risque des matériaux au contact des denrées alimentaires
2017
International audience; Les matériaux au contact des denrées alimentaires (MCDA) jouent un rôle incontournable en matière de conservation et de protection des aliments. Cependant, des substances de l'emballage (monomères, additifs) peuvent migrer dans les aliments. Ainsi, pour être aptes au contact alimentaire, les MCDA ne doivent pas libérer des substances en une quantité qui pourrait mettre en danger la santé humaine ou modifier les caractères organoleptiques et la composition des aliments : c'est le principe d'inertie du Règlement no 1935/2004 du Parlement européen et du Conseil sur les MCDA. De plus, une réglementation harmonisée au niveau européen existe pour certains matériaux (cas de…
A butterfly like motion as a clue to the photophysics of thioxanthone
2006
Abstract A theoretical, quantum-chemical study of the thioxanthone (TX) molecule has been performed at the MP2 and CASPT2 levels of theory. Geometries, absorption energies, and transition and state properties have been investigated. Two conformers have been found very close in energy with planar (P) and non-planar (NP) structures, the latter characterized by a dihedral angle θ = 173.3° representing the bend of the side benzene rings and an out-of-plane angle ϕ = 4° of the C O bond. Large changes in the relative positions and properties of the two low-lying electronic absorption bands, ππ * and nπ * , are computed when changing the conformation. As a consequence of the analysis of the TX a…
Non-ionic photo-acid generators for applications in two-photon lithography
2009
Non-ionic photoacid generators (PAGs) have been designed and synthesized for use in two-photon lithography (TPL). The chromophores in these new PAGs are covalently linked to the photocleavable group by a flexible joint. Their thermal stability, solubility and efficiency to produce acid under both one- and two-photon excitation were characterized. The potential of these PAGs for TPL was tested in two negative-tone resist systems relying on different mechanisms: free-radical/cationic polymerization or a cationically initiated cross-linking reaction. These PAGs needed lower threshold power for polymerization compared to a commercially available photoinitiator, isopropylthioxanthone, and a phot…
Thioxanthone: on the shape of the first absorption band
2010
The equilibrium ground state geometry of thioxanthone (TX) has been investigated and its effect on the vertical excitation energies and photophysical behaviour has been explained. In line with this purpose, the first absorption band of TX has been simulated and analysed in detail. The calculations show that TX is planar, C(2v) symmetric in its ground state. The energy of the low-lying excited states seems to be rather insensitive along the butterfly motion coordinate. The shoulder in the first absorption band (at around 3.43 eV) is shown to be caused by vibrational progression of various in-plane modes and does not justify the hypothesis that two photophysically distinct conformers of TX ex…
Solid Solutions in the Xanthone–Thioxanthone Binary System: How Well Are Similar Molecules Discriminated in the Solid State?
2020
The binary system of xanthone–thioxanthone has been explored, showing that two solid solutions (formed based on xanthone and thioxanthone parent structures, respectively) exist for this system. One...