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Record W4411102414 · doi:10.26434/chemrxiv-2025-pz7r7

Mechanochemical and aging-based SN2 method to access CO2-responsive, high-amine-loading chitosan

2025· preprint· en· W4411102414 on OpenAlexafffund
Galen Yang, Rachel S. Korchinsky, Justine Sauvé‐St‐Pierre, Philip G. Jessop, Edmond Lam, Audrey Moores

Bibliographic record

VenueChemRxiv · 2025
Typepreprint
Languageen
FieldChemical Engineering
TopicCarbon dioxide utilization in catalysis
Canadian institutionsMcGill University
FundersFonds de recherche du Québec – Nature et technologiesCanada Foundation for InnovationCentre in Green Chemistry and CatalysisNatural Sciences and Engineering Research Council of CanadaMcGill University
KeywordsChitosanAmine gas treatingSN2 reactionChemistryChemical engineeringBusinessCombinatorial chemistryBiochemistryOrganic chemistryEngineering

Abstract

fetched live from OpenAlex

Tertiary amines in water exhibit CO2-responsiveness through the equilibrium between the neutral form and the tertiary ammonium bicarbonate salt. This phenomenon makes it possible to use CO2 to trigger reversible property changes such as a change in the osmotic pressure (π), which is useful for forward osmosis, a membrane-based water separation technique. Chitosan, the deacetylated derivative of the abundant nitrogen-containing natural polymer chitin, is a great biopolymer carrier of desired functionalities through chemical modification. Herein, we report a mechanochemical and aging-based method to functionalize chitosan with a tertiary amine in a one-pot SN2-type aminoalkylation reaction. The reaction afforded chitosan with a high degree of substitution (DS), up to 1.67 per sugar unit, doubling the previously reported DS achieved with solvothermal methods. Unique to this method is its ability to functionalize both the amine and the primary alcohol groups of chitosan. The reaction proceeded well with catalytic amounts of liquid and only stoichiometric amounts of reagent, a favourable improvement upon past reports, which all used excess reagent. It was also scalable and demonstrated on a range of molecular weights. We also showed that O-functionalization was effective on chitin up to a DS of 0.15. The π of aqueous solutions of the aminoalkylated chitosan reversibly increases 47% upon carbonation. This work showcases how mechanochemistry can deliver greatly improved DS on the functionalization of recalcitrant substrates, such as chitinous biomass, with reduced process mass intensity and energy use compared to past works to deliver a CO2-responsive material based on biomass.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.002
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow)
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: none
Teacher disagreement score0.532
Threshold uncertainty score0.999

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.002
Meta-epidemiology (narrow)0.0010.001
Meta-epidemiology (broad)0.0010.000
Bibliometrics0.0010.001
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0010.003
Research integrity0.0010.001
Insufficient payload (model declined to judge)0.0000.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.021
GPT teacher head0.318
Teacher spread0.298 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one teacher head, not a consensus.

Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations1
Published2025
Admission routes2
Has abstractyes

Explore more

Same venueChemRxivSame topicCarbon dioxide utilization in catalysisFrench-language works237,207