|
2013 Journal Article Hydrazine-mediated Reduction of Nitro and Azide Functionalities Catalyzed by Highly Active and Reusable Magnetic Iron Oxide NanocrystalsCantillo, David, Moghaddam, Mojtaba Mirhosseini and Kappe, C. Oliver (2013). Hydrazine-mediated Reduction of Nitro and Azide Functionalities Catalyzed by Highly Active and Reusable Magnetic Iron Oxide Nanocrystals. Journal of Organic Chemistry, 78 (9), 4530-4542. doi: 10.1021/jo400556g |
|
2013 Journal Article On the Fischer indole synthesis of 7-ethyltryptophol-mechanistic and process intensification studies under continuous flow conditionsGutmann, Bernhard, Gottsponer, Michael, Elsner, Petteri, Cantillo, David, Roberge, Dominique M. and Kappe, C. Oliver (2013). On the Fischer indole synthesis of 7-ethyltryptophol-mechanistic and process intensification studies under continuous flow conditions. Organic Process Research and Development, 17 (2), 294-302. doi: 10.1021/op300363s |
|
2012 Journal Article An experimental and computational assessment of acid-catalyzed azide-nitrile cycloadditionsCantillo, David, Gutmann, Bernhard and Kappe, C. Oliver (2012). An experimental and computational assessment of acid-catalyzed azide-nitrile cycloadditions. The Journal of Organic Chemistry, 77 (23), 10882-10890. doi: 10.1021/jo3022742 |
|
2012 Journal Article Can electromagnetic fields influence the structure and enzymatic digest of proteins? A critical evaluation of microwave-assisted proteomics protocolsDamm, Markus, Nusshold, Christoph, Cantillo, David, Rechberger, Gerald N., Gruber, Karl, Sattler, Wolfgang and Kappe, C. Oliver (2012). Can electromagnetic fields influence the structure and enzymatic digest of proteins? A critical evaluation of microwave-assisted proteomics protocols. Journal of Proteomics, 75 (18), 5533-5543. doi: 10.1016/j.jprot.2012.07.043 |
|
2012 Journal Article On the prebiotic synthesis of D-sugars catalyzed by L-peptides: assessments from first-principles calculationsCantillo, David, Avalos, Martin, Babiano, Reyes, Cintas, Pedro, Jimenez, Jose L. and Palacios, Juan C. (2012). On the prebiotic synthesis of D-sugars catalyzed by L-peptides: assessments from first-principles calculations. Chemistry: A European Journal, 18 (28), 8795-8799. doi: 10.1002/chem.201200466 |
|
2012 Journal Article Direct arylation of benzene with aryl bromides using high-temperature/high-pressure process windows: expanding the scope of C-H activation chemistryPieber, Bartholomaus, Cantillo, David and Kappe, C. Oliver (2012). Direct arylation of benzene with aryl bromides using high-temperature/high-pressure process windows: expanding the scope of C-H activation chemistry. Chemistry: A European Journal, 18 (16), 5047-5055. doi: 10.1002/chem.201103748 |
|
2012 Journal Article Flash flow pyrolysis: mimicking flash vacuum pyrolysis in a high-temperature/high-pressure liquid-phase microreactor environmentCantillo, David, Sheibani, Hassan and Kappe, C. Oliver (2012). Flash flow pyrolysis: mimicking flash vacuum pyrolysis in a high-temperature/high-pressure liquid-phase microreactor environment. The Journal of Organic Chemistry, 77 (5), 2463-2473. doi: 10.1021/jo3001645 |
|
2012 Journal Article Fast and reliable location of stationary points in a reaction pathCantillo, David, Avalos, Martin, Babiano, Reyes, Cintas, Pedro, Jimenez, Jose L. and Palacios, Juan C. (2012). Fast and reliable location of stationary points in a reaction path. Journal of Physical Organic Chemistry, 25 (1), 77-82. doi: 10.1002/poc.1877 |
|
2012 Journal Article In situ generated iron oxide nanocrystals as efficient and selective catalysts for the reduction of nitroarenes using a continuous flow methodCantillo, David, Baghbanzadeh, Mostafa and Kappe, C. Oliver (2012). In situ generated iron oxide nanocrystals as efficient and selective catalysts for the reduction of nitroarenes using a continuous flow method. Angewandte Chemie (International Edition), 51 (40), 10190-10193. doi: 10.1002/anie.201205792 |
|
2012 Journal Article On the mechanism of the Dakin-West reactionDalla-Vechia, Luciana, Santos, Vanessa G., Godoi, Marla N., Cantillo, David, Kappe, C. Oliver, Eberlin, Marcos N., de Souza, Rodrigo O. M. A. and Miranda, Leandro S. M. (2012). On the mechanism of the Dakin-West reaction. Organic and Biomolecular Chemistry, 10 (45), 9013-9020. doi: 10.1039/c2ob26560e |
|
2011 Journal Article Mechanistic insights on the ruthenium-catalyzed hydrogenation of amides - C-N vs. C-O cleavageCantillo, David (2011). Mechanistic insights on the ruthenium-catalyzed hydrogenation of amides - C-N vs. C-O cleavage. European Journal of Inorganic Chemistry, 2011 (19), 3008-3013. doi: 10.1002/ejic.201100443 |
|
2011 Journal Article Mechanistic insights on azide-nitrile cycloadditions: On the dialkyltin oxide-trimethylsilyl azide route and a new vilsmeier-haack-type organocatalystCantillo, David, Gutmann, Bernhard and Kappe, C. Oliver (2011). Mechanistic insights on azide-nitrile cycloadditions: On the dialkyltin oxide-trimethylsilyl azide route and a new vilsmeier-haack-type organocatalyst. Journal of the American Chemical Society, 133 (12), 4465-4475. doi: 10.1021/ja109700b |
|
2011 Journal Article On the enhanced reactivity and selectivity of triazole formation in molecular flasks. A theoretical rationaleCantillo, David, Avalos, Martin, Babiano, Reyes, Cintas, Pedro, Jimenez, Jose L. and Palacios, Juan C. (2011). On the enhanced reactivity and selectivity of triazole formation in molecular flasks. A theoretical rationale. Organic and Biomolecular Chemistry, 9 (22), 7638-7642. doi: 10.1039/c1ob06206a |
|
2011 Journal Article Assessing the whole range of CuAAC mechanisms by DFT calculations-on the intermediacy of copper acetylidesCantillo, David, Avalos, Martin, Babiano, Reyes, Cintas, Pedro, Jimenez, Jose L. and Palacios, Juan C. (2011). Assessing the whole range of CuAAC mechanisms by DFT calculations-on the intermediacy of copper acetylides. Organic and Biomolecular Chemistry, 9 (8), 2952-2958. doi: 10.1039/c0ob01001d |
|
2010 Journal Article A unified mechanistic view on the Morita-Baylis-Hillman reaction: computational and experimental investigationsCantillo, David and Kappe, C. Oliver (2010). A unified mechanistic view on the Morita-Baylis-Hillman reaction: computational and experimental investigations. The Journal of Organic Chemistry, 75 (24), 8615-8626. doi: 10.1021/jo102094h |
|
2010 Journal Article Unusual aryl migration in a mesmeric betaine in the solid and liquid state: mechanistic insights into the SNAr reactionCantillo, David, Avalos, Martin, Babiano, Reyes, Cintas, Pedro, Jimenez, Jose L., Light, Mark E. and Palacios, Juan C. (2010). Unusual aryl migration in a mesmeric betaine in the solid and liquid state: mechanistic insights into the SNAr reaction. The Journal of Organic Chemistry, 75 (12), 4300-4303. doi: 10.1021/jo100350t |
|
2010 Journal Article Push-pull 1,3-thiazolium-5-thiolates. Formation via concerted and stepwise pathways, and theoretical evaluation of NLO propertiesCantillo, David, Avalos, Martin, Babiano, Reyes, Cintas, Pedro, Jimenez, Jose L., Light, Mark E., Palacios, Juan C. and Rodriguez, Valentin (2010). Push-pull 1,3-thiazolium-5-thiolates. Formation via concerted and stepwise pathways, and theoretical evaluation of NLO properties. Organic and Biomolecular Chemistry, 8 (23), 5367-5374. doi: 10.1039/c0ob00416b |
|
2009 Journal Article Dissecting competitive mechanisms: thionation vs. cycloaddition in the reaction of thioisomunchnones with isothiocyanates under microwave irradiationCantillo, David, Avalos, Martin, Babiano, Reyes, Cintas, Pedro, Jimenez, Jose L., Light, Mark E. and Palacios, Juan C. (2009). Dissecting competitive mechanisms: thionation vs. cycloaddition in the reaction of thioisomunchnones with isothiocyanates under microwave irradiation. The Journal of Organic Chemistry, 74 (20), 7644-7650. doi: 10.1021/jo900960a |
|
2009 Journal Article Thionation of mesoionics with isothiocyanates: evidence supporting a four-step domino process and ruling out a [2+2] mechanismCantillo, David, Avalos, Martin, Babiano, Reyes, Cintas, Pedro, Jimenez, Jose L., Light, Mark E. and Palacios, Juan C. (2009). Thionation of mesoionics with isothiocyanates: evidence supporting a four-step domino process and ruling out a [2+2] mechanism. The Journal of Organic Chemistry, 74 (10), 3698-3705. doi: 10.1021/jo900028c |
|
2008 Journal Article Stepwise cycloadditions of mesoionic systems: thionation of thioisomunchnones by isothlocyanatesCantillo, David, Avalos, Martin, Babiano, Reyes, Cintas, Pedro, Jimenez, Jose L., Light, Mark E. and Palacios, Juan C. (2008). Stepwise cycloadditions of mesoionic systems: thionation of thioisomunchnones by isothlocyanates. Organic Letters, 10 (6), 1079-1082. doi: 10.1021/ol702929k |
