Steven Le Vot, Sabri Messaoudi, Olivier Fontaine, Rahma Hachicha, Frédéric Favier, Ramzi Zarrougui, Ouassim Ghodbane, Institut National de Recherche et d'Analyse Physico-Chimique (INRAP), Université de Tunis - El Manar II, Université de Tunis El Manar (UTM), Institut Charles Gerhardt Montpellier - Institut de Chimie Moléculaire et des Matériaux de Montpellier (ICGM ICMMM), Ecole Nationale Supérieure de Chimie de Montpellier (ENSCM)-Centre National de la Recherche Scientifique (CNRS)-Université de Montpellier (UM)-Université Montpellier 1 (UM1)-Université Montpellier 2 - Sciences et Techniques (UM2)-Institut de Chimie du CNRS (INC), Faculté des Sciences de Bizerte [Université de Carthage], Université de Carthage - University of Carthage, Réseau sur le stockage électrochimique de l'énergie (RS2E), Université de Picardie Jules Verne (UPJV)-Institut de Chimie du CNRS (INC)-Aix Marseille Université (AMU)-Université de Pau et des Pays de l'Adour (UPPA)-Université de Nantes (UN)-Université de Montpellier (UM)-Centre National de la Recherche Scientifique (CNRS)-Sorbonne Université (SU)-Ecole Nationale Supérieure de Chimie de Paris - Chimie ParisTech-PSL (ENSCP), Université Paris sciences et lettres (PSL)-Université Paris sciences et lettres (PSL)-Université de Haute-Alsace (UHA) Mulhouse - Colmar (Université de Haute-Alsace (UHA))-Collège de France (CdF (institution))-Institut polytechnique de Grenoble - Grenoble Institute of Technology (Grenoble INP ), Université Grenoble Alpes (UGA)-Université Grenoble Alpes (UGA)-Institut National Polytechnique (Toulouse) (Toulouse INP), Université Fédérale Toulouse Midi-Pyrénées-Université Fédérale Toulouse Midi-Pyrénées-Ecole Nationale Supérieure de Chimie de Montpellier (ENSCM), This work was supported by the PHC-UTIQUE project (code 17G 1209), managed by the CMCU Committee, between Charles Gerhardt Institute of Montpellier (France) and National Institute of Research and Physico-chemical Analysis (Tunisia). Furthermore, the authors thank all the staff of the Useful Materials Laboratory (LMU) and especially, Pr. Mohieddine Abdellaoui for the electrochemical analyses and Moomen Marzouki and Riadh Hamdi for helpful discussions., University of Tunis El Manar, Institut Charles Gerhardt Montpellier - Institut de Chimie Moléculaire et des Matériaux de Montpellier (ICGM), Ecole Nationale Supérieure de Chimie de Montpellier (ENSCM)-Institut de Chimie du CNRS (INC)-Université de Montpellier (UM)-Centre National de la Recherche Scientifique (CNRS), Université de Nantes (UN)-Aix Marseille Université (AMU)-Université de Haute-Alsace (UHA) Mulhouse - Colmar (Université de Haute-Alsace (UHA))-Collège de France (CdF (institution))-Université de Picardie Jules Verne (UPJV)-Ecole Nationale Supérieure de Chimie de Montpellier (ENSCM)-Ecole Nationale Supérieure de Chimie de Paris - Chimie ParisTech-PSL (ENSCP), Université Paris sciences et lettres (PSL)-Université Paris sciences et lettres (PSL)-Université de Pau et des Pays de l'Adour (UPPA)-Institut de Chimie du CNRS (INC)-Université de Montpellier (UM)-Sorbonne Université (SU)-Centre National de la Recherche Scientifique (CNRS)-Institut National Polytechnique (Toulouse) (Toulouse INP), Université de Toulouse (UT)-Université de Toulouse (UT)-Institut polytechnique de Grenoble - Grenoble Institute of Technology (Grenoble INP ), and Université Grenoble Alpes (UGA)-Université Grenoble Alpes (UGA)
International audience; A series of novel ionic liquids (ILs) based on N-allyl-N,N-dimethylethylammonium (N112A+) are synthesized and characterized. Their physical properties and electrochemical stabilities are investigated and discussed toward the anion constituents. Herein, four anions are studied including one planar non-fluorinated anion (DCA−) and three fluorinated anions (TFSI−, OTf−, TFA−). The experimental properties are compared to those predicted by density functional theory (DFT) calculations. All salts are found to be low melting compounds while being liquid at room temperature. N112A-TFSI is the most thermally stable (Td = 329 °C) and N112A-TFA is the least stable (Td = 158 °C). The temperature effect on ILs transport properties is determined and discussed using the ionicity and Angell's fragility concepts. Among the good and fragile prepared ILs, N112A –DCA exhibits outstanding transport properties thanks to the low dynamic viscosity (19.97 mPa·s) and high ionic conductivity (19.20 mS·cm−1) reached at 298 K. These suitable properties are explained, from theoretical calculations, by the lower intermolecular interactions of ion-pairs in N112A –DCA and quantified by the decreased value of dispersion ion-pairs interaction energy (−6 kJ·mol−1). The electrochemical stability window (ESW) of selected ILs is strongly affected by the anion structure. The ESW values are found to decrease in the following order N112A-TFSI (4.40 V) > N112A-OTf (3.80 V) > N112A-DCA (3.00 V) > N112A-TFA (2.18 V). Taking into account the most likely oxidation and reduction reactions, the ESWs are discussed and validated by the density-based solvent model (SMD). The experimental values of ESWs are very close to the predicted ones.