Skip to main content

Continuous Resolution and Deracemization of Chiral Compounds by Crystallization

Deliverables

ESR presentation on tool during workshop 2 / conference

The ESRs will present their findings during the dedicated network events in short, focussed presentations

Searching for OpenAIRE data...

Publications

Chiral solid state screening and phase diagrams

Author(s): Harfouche, Lina
Published in: https://www.theses.fr/2020NORMR007, Issue 1, 2020

Practical aspects on how to deracemize atropizomers by means of crystallization

Author(s): Oketani, Ryusei
Published in: https://tel.archives-ouvertes.fr/tel-02502796v1, Issue 1, 2019

Recherche de Conglomérats pour la résolution chirale par voie de cristallisation

Author(s): Mbodji, Aliou
Published in: https://tel.archives-ouvertes.fr/tel-02917352, Issue 1, 2020

Deracemization of NMPA via Temperature Cycles

Author(s): Francesca Breveglieri, Giovanni Maria Maggioni, Marco Mazzotti
Published in: Crystal Growth & Design, Issue 18/3, 2018, Page(s) 1873-1881, ISSN 1528-7483
DOI: 10.1021/acs.cgd.7b01746

Practical Role of Racemization Rates in Deracemization Kinetics and Process Productivities

Author(s): Ryusei Oketani, Marine Hoquante, Clément Brandel, Pascal Cardinael, Gérard Coquerel
Published in: Crystal Growth & Design, Issue October 2018, 2018, ISSN 1528-7483
DOI: 10.1021/acs.cgd.8b01263

Population-Based Mathematical Model of Solid-State Deracemization via Temperature Cycles

Author(s): Brigitta Bodák, Giovanni Maria Maggioni, Marco Mazzotti
Published in: Crystal Growth & Design, Issue 9 October 2018 (web), 2018, ISSN 1528-7483
DOI: 10.1021/acs.cgd.8b01292

Role of Additives during Deracemization Using Temperature Cycling

Author(s): Giuseppe Belletti, Hugo Meekes, Floris P. J. T. Rutjes, Elias Vlieg
Published in: Crystal Growth & Design, Issue 2 October 2018 (web), 2018, ISSN 1528-7483
DOI: 10.1021/acs.cgd.8b00856

NH-form of a threonine-based Schiff base in the solid state

Author(s): Ryusei Oketani, Hiroki Takahashi, Marine Hoquante, Clément Brandel, Pascal Cardinael, Gérard Coquerel
Published in: Journal of Molecular Structure, Issue 1184, 2019, Page(s) 36-40, ISSN 0022-2860
DOI: 10.1016/j.molstruc.2019.01.093

Cocrystals in the Cambridge Structural Database: a network approach

Author(s): Jan-Joris Devogelaer, Hugo Meekes, Elias Vlieg, René de Gelder
Published in: Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, Issue 75/3, 2019, Page(s) 371-383, ISSN 2052-5206
DOI: 10.1107/s2052520619004694

Resolution of Racemic Guaifenesin Applying a Coupled Preferential Crystallization-Selective Dissolution Process: Rational Process Development

Author(s): Erik Temmel, Matthias J. Eicke, Francesca Cascella, Andreas Seidel-Morgenstern, Heike Lorenz
Published in: Crystal Growth & Design, 2019, ISSN 1528-7483
DOI: 10.1021/acs.cgd.8b01660

Resolution of an Atropisomeric Naphthamide by Second-Order Asymmetric Transformation: A Highly Productive Technique

Author(s): Ryusei Oketani, Marine Hoquante, Clément Brandel, Pascal Cardinael, Gérard Coquerel
Published in: Organic Process Research & Development, 2019, ISSN 1083-6160
DOI: 10.1021/acs.oprd.9b00133

Role of Racemization Kinetics in the Deracemization Process via Temperature Cycles

Author(s): Francesca Breveglieri, Marco Mazzotti
Published in: Crystal Growth & Design, 2019, ISSN 1528-7483
DOI: 10.1021/acs.cgd.9b00410

Deracemization in a complex quaternary system with a second‐order asymmetric transformation using phase diagram studies

Author(s): Ryusei Oketani, Francesco Marin, Paul Tinnemans, Marine Hoquante, Anne Laurent, Clément Brandel, Pascal Cardinael, Hugo Meekes, Elias Vlieg, Yves Geerts, Gerard Coquerel
Published in: Chemistry – A European Journal, 2019, ISSN 0947-6539
DOI: 10.1002/chem.201903338

Family of conglomerate forming systems composed of chlocyphos and alkyl-amine. Assessment of their resolution performances by using various modes of preferential crystallization

Author(s): Aliou Mbodji, Gabin Gbabode, Morgane Sanselme, Nicolas Couvrat, Michel Leeman, Valérie Dupray, Richard M. Kellogg, Gérard Coquerel
Published in: Crystal Growth & Design, 2019, ISSN 1528-7483
DOI: 10.1021/acs.cgd.9b00568

Effect of Initial Conditions on Solid-State Deracemization via Temperature Cycles: A Model-Based Study

Author(s): Brigitta Bodák, Giovanni Maria Maggioni, Marco Mazzotti
Published in: Crystal Growth & Design, Issue 19/11, 2019, Page(s) 6552-6559, ISSN 1528-7483
DOI: 10.1021/acs.cgd.9b00988

Shortcut Model for Describing Isothermal Batch Preferential Crystallization of Conglomerates and Estimating the Productivity

Author(s): Thiane Carneiro, Shashank Bhandari, Erik Temmel, Heike Lorenz, Andreas Seidel-Morgenstern
Published in: Crystal Growth & Design, Issue 19/9, 2019, Page(s) 5189-5203, ISSN 1528-7483
DOI: 10.1021/acs.cgd.9b00592

Enabling Direct Preferential Crystallization in a Stable Racemic Compound System

Author(s): Lina C. Harfouche, Clément Brandel, Yohann Cartigny, Joop H. ter Horst, Gérard Coquerel, Samuel Petit
Published in: Molecular Pharmaceutics, Issue 16/11, 2019, Page(s) 4670-4676, ISSN 1543-8384
DOI: 10.1021/acs.molpharmaceut.9b00805

Photoracemization‐Based Viedma Ripening of a BINOL Derivative

Author(s): Giuseppe Belletti, Carola Tortora, Indradevi D. Mellema, Paul Tinnemans, Hugo Meekes, Floris P. J. T. Rutjes, Svetlana B. Tsogoeva, Elias Vlieg
Published in: Chemistry – A European Journal, 2019, Page(s) online, ISSN 0947-6539
DOI: 10.1002/chem.201904382

Toward Continuous Deracemization via Racemic Crystal Transformation Monitored by in Situ Raman Spectroscopy

Author(s): Christos Xiouras, Giuseppe Belletti, Raghunath Venkatramanan, Alison Nordon, Hugo Meekes, Elias Vlieg, Georgios D. Stefanidis, Joop H. Ter Horst
Published in: Crystal Growth & Design, Issue 19/10, 2019, Page(s) 5858-5868, ISSN 1528-7483
DOI: 10.1021/acs.cgd.9b00867

Cocrystal design by network-based link prediction

Author(s): Jan-Joris Devogelaer, Sander J. T. Brugman, Hugo Meekes, Paul Tinnemans, Elias Vlieg, René de Gelder
Published in: CrystEngComm, Issue 21/44, 2019, Page(s) 6875-6885, ISSN 1466-8033
DOI: 10.1039/c9ce01110b

Efficient Resolution of Racemic Guaifenesin via Batch-Preferential Crystallization Processes

Author(s): Francesca Cascella, Erik Temmel, Andreas Seidel-Morgenstern, Heike Lorenz
Published in: Organic Process Research & Development, Issue 24/1, 2020, Page(s) 50-58, ISSN 1083-6160
DOI: 10.1021/acs.oprd.9b00413

Exploiting Ternary Solubility Phase Diagrams for Resolution of Enantiomers: An Instructive Example

Author(s): Francesca Cascella, Andreas Seidel-Morgenstern, Heike Lorenz
Published in: Chemical Engineering & Technology, 2020, Page(s) online, ISSN 0930-7516
DOI: 10.1002/ceat.201900421

Evidence of conglomerate with partial solid solutions in ethylammonium chlocyphos

Author(s): Aliou Mbodji, Gabin Gbabode, Morgane Sanselme, Yohann Cartigny, Nicolas Couvrat, Michel Leeman, Valérie Dupray, Richard M. Kellogg, Gérard Coquerel
Published in: Crystal Growth & Design, 2020, ISSN 1528-7483
DOI: 10.1021/acs.cgd.9b01699

Discovery of New Proxyphylline Based Chiral Cocrystals: Solid State Landscape and Dehydration Mechanism

Author(s): Lina C. Harfouche, Nicolas Couvrat, Morgane Sanselme, Clément Brandel, Yohann Cartigny, Samuel Petit, Gérard Coquerel
Published in: Crystal Growth & Design, 2020, ISSN 1528-7483
DOI: 10.1021/acs.cgd.0c00149

Speeding up Viedma Deracemization through Water catalyzed and Reactant Self‐catalyzed Racemization

Author(s): Carola Tortora, Christina Mai, Francesca Cascella, Michael Mauksch, Andreas Seidel-Morgenstern, Heike Lorenz, Svetlana B. Tsogoeva
Published in: ChemPhysChem, 2020, ISSN 1439-4235
DOI: 10.1002/cphc.202000493

Cocrystal prediction by artificial neural networks

Author(s): Jan-Joris Devogelaer, Hugo Meekes, Paul Tinnemans, Elias Vlieg, Rene De Gelder
Published in: Angewandte Chemie International Edition, Issue Online: 14 August 2020, 2020, ISSN 1433-7851
DOI: 10.1002/anie.202009467

Combining Incompatible Processes for Deracemization of a Praziquantel Derivative under Flow Conditions

Author(s): Giulio Valenti, Dr. Paul Tinnemans, Dr. Iaroslav Baglai, Prof. Dr. Willem L. Noorduin, Dr. Bernard Kaptein, Dr. Michel Leeman, Prof. Joop H. ter Horst, Prof. Dr. Richard M. Kellogg
Published in: Angewandte Chemie International Edition, Issue 60(10), 2021, Page(s) 5279-5282, ISSN 1433-7851
DOI: 10.1002/anie.202013502

Performance Analysis and Model-Free Design of Deracemization via Temperature Cycles

Author(s): Francesca Breveglieri, Iaroslav Baglai, Michel Leeman, Willem L. Noorduin, Richard M. Kellogg, Marco Mazzotti
Published in: Organic Process Research & Development, Issue 24/8, 2020, Page(s) 1515-1522, ISSN 1083-6160
DOI: 10.1021/acs.oprd.0c00266