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Record W7005841770

Shifting To Renewable Furan Candidates: Synthesis and Study of New Optoelectronic Materials

2024· dissertation· en· W7005841770 on OpenAlexfundno aff

Bibliographic record

VenueSpectrum Research Repository (Concordia University) · 2024
Typedissertation
Languageen
FieldBiochemistry, Genetics and Molecular Biology
TopicDevelopmental Biology and Gene Regulation
Canadian institutionsnot available
FundersConcordia University
KeywordsYield (engineering)Work (physics)Raw materialQuality (philosophy)NucleofectionProduction (economics)
DOInot available

Abstract

fetched live from OpenAlex

With climate concerns consistently growing, the chemical industry must shift away from petrochemicals and turn to sustainable feedstocks derived from lignocellulosic biomass. There is urgency to develop new synthetic methodologies that effectively convert biomass-derived starting materials into useful consumer products. The production of multi-arylated furans and 2,5-furan-based oligomers, has gained popularity as organic candidates for light-emitting diodes or field-effect transistors, owing to their favourable optoelectronic properties found in highly conjugated furan-based materials. Hydroxymethylfurfural and furfural are biomass-derived platform chemicals that have received attention as raw materials due to their chemical functionality, renewability, and capability to produce various furan-containing building blocks. In this work, we aim to develop a synthetic methodology starting from biomass-derived chemicals to design potential optoelectronics. Hydroxymethylfurfural was studied to develop multi-arylated furans; however, a rigid diol monomer was synthesized instead. Working with methyl-5-bromofuran-2-carboxylate led to three different multi-arylated furans via regioselective halogenations followed by Pd-catalyzed cross-coupling reactions. 5-Bromofurfural, a close derivative of biomass-derived furfural, was an ideal candidate to produce ten 2,5-furan-based oligomers and one 2,5-furan-based push-pull chromophore. To rapidly extend the π-conjugation of each material, a double Pd-catalyzed decarboxylative cross-coupling (DCC) reaction was utilized. This strategy fuses two nucleophilic arylated furan acids with a dihalogenated aryl linker to produce highly planar furan-based oligomers. Regarding overall yields of the double DCC, electron-neutral and electron-donating furan acids exhibited higher yields (32 – 74%) than electron-withdrawing acid derivatives (18 – 21%). All furan-based compounds were then characterized by NMR and their absorbance, photoluminescence and quantum yields were studied in dilute solution.

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 machine prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
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 score0.001
Threshold uncertainty score0.004

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.001
Open science0.0000.000
Research integrity0.0000.001
Insufficient payload (model declined to judge)0.0010.001

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 head0.014
GPT teacher head0.277
Teacher spread0.263 · 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 source (direct Gemma or distilled Codex), not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
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 routes1
Has abstractyes

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