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Record W4405654634 · doi:10.26434/chemrxiv-2024-nkqt1

Terpene-derived polyester-block-polycarbonates using metal-free catalysis

2024· preprint· en· W4405654634 on OpenAlexafffund
Mikhailey D. Wheeler, Andrew Kinsman, Francesca M. Kerton

Bibliographic record

VenueChemRxiv · 2024
Typepreprint
Languageen
FieldChemical Engineering
TopicCarbon dioxide utilization in catalysis
Canadian institutionsMemorial University of Newfoundland
FundersNewfoundland and LabradorMemorial University of NewfoundlandMitacsCanada Foundation for InnovationNatural Sciences and Engineering Research Council of CanadaFulbright Canada
KeywordsPolyesterPolymer chemistryCyclohexene oxidePropylene oxidePolymerOrganic chemistryChemistryPolymerizationMaleic anhydrideCopolymerMaterials scienceEthylene oxide

Abstract

fetched live from OpenAlex

Sustainable materials are a large research focus due to depleting resources and increasing environmental pollution. Therefore, bio-derived building blocks from renewable feedstocks are being pursued as an alternative to fossil-derivatives for producing polymers. Here, we have prepared a series of polyester and polyester-block-polycarbonate copolymers from a metal-free ring-opening copolymerization (ROCOP) of various terpene-derived cyclic anhydrides, epoxides (cyclohexene oxide (CHO) and propylene oxide (PO)), and carbon dioxide (CO2) under neat (solvent-free) conditions. Cyclic anhydrides were prepared via microwave-assisted Diels Alder reactions between terpenes and maleic anhydride (up to 90% yield). The ROCOP catalyst system consisted of triphenylborane (BPh3) with bis(triphenylphosphine)iminium chloride (PPNCl) and, after complete conversion of anhydride, resulted in polymers with moderate molecular weights (Mn up to 21 kDa), and good dispersities (between 1.05 and 1.75). Thermal analysis resulted in a single glass transition temperature (between 1.5 C and 101 C) indicating amorphic materials. 13C{1H} NMR spectroscopy revealed high stereoregularity with respect to substituent methyl groups and di-ester units and 2D DOSY NMR spectroscopy confirmed a single polymer chain was formed by sequential copolymerizations. Residual olefinic groups in the polymer backbone provides opportunity for post-polymerization functionalization and, therefore, further tailoring of macroscopic properties.

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)0.001
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: Empirical
Teacher disagreement score0.131
Threshold uncertainty score0.999

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.001
Meta-epidemiology (narrow)0.0010.001
Meta-epidemiology (broad)0.0010.001
Bibliometrics0.0010.001
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0020.006
Research integrity0.0010.002
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 head0.022
GPT teacher head0.260
Teacher spread0.237 · 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

Citations0
Published2024
Admission routes2
Has abstractyes

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