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Record W1982243171 · doi:10.1139/v01-012

Fluorous biphasic catalysis. 2. Synthesis of fluoroponytailed amine ligands along with fluoroponytailed carboxylate synthons, [M(C<sub>8</sub>F<sub>17</sub>(CH<sub>2</sub>)<sub>2</sub>CO<sub>2</sub>)<sub>2</sub>] (M = Mn<sup>2+</sup> or Co<sup>2+</sup>): Demonstration of a perfluoroheptane soluble precatalyst for alkane and alkene functionalization in the presence of <i>tert</i>-butyl hydroperoxide and oxygen gas

2001· article· en· W1982243171 on OpenAlexvenueno aff
Jean‐Marc Vincent, Alain Rabion, Vittal K. Yachandra, Richard H. Fish

Bibliographic record

VenueCanadian Journal of Chemistry · 2001
Typearticle
Languageen
FieldPharmacology, Toxicology and Pharmaceutics
TopicFluorine in Organic Chemistry
Canadian institutionsnot available
FundersLawrence Berkeley National LaboratoryU.S. Department of Energy
KeywordsSynthonChemistryCatalysisCarboxylateLigand (biochemistry)Amine gas treatingSubstrate (aquarium)Homogeneous catalysisTrisMedicinal chemistryFluorocarbonReactivity (psychology)Organic chemistryStereochemistry

Abstract

fetched live from OpenAlex

Fluorous biphasic catalysis (FBC) is a relatively new concept for homogeneous catalysis where the fluorocarbon soluble catalyst resides in a separate phase from the substrate and products. Therefore, separation of the catalyst and the products occurs by a facile decantation process. In this contribution, we present the synthesis of new R f -fluoroponytailed synthons, 2-iodo-1-perfluorooctyl-3-propanol (1), 3-perfluorooctyl-1-propanol (2), and 3-perfluorooctyl-1-iodopropane (3), a variety of new R f -fluoroponytailed ligands (4–8), with starting amines, 1,4,7-triazacyclononane, bis-picolylamine, and bis-picolylaminoethylenediamine, as well as new R f Mn 2+ and R f Co 2+ fluoroponytailed carboxylate synthons, [Mn(O 2 C(CH 2 ) 2 C 8 F 17 ) 2 ] (9), and [Co(O 2 C(CH 2 ) 2 C 8 F 17 ) 2 ] (10), where R f is C 8 F 17 . The only totally perfluoralkane soluble ligand we found was 1,4,7-tris-N-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)-1,4,7-triazacyclononane (R f TACN, 4), and it was utilized, along with synthons 9 and 10, to generate in situ R f Mn 2+ –R f TACN and R f Co 2+ –R f TACN complexes as precatalysts for functionalization of alkanes and alkenes. We will demonstrate that indeed this novel FBC approach for the separation of the precatalyst from the substrates and (or) products is viable for oxidation of alkanes and alkenes in the presence of the necessary oxidants, tert-butyl hydroperoxide (TBHP), and O 2 gas. We will also show that these oxidation reactions occur via an autoxidation mechanism under our FBC conditions, while using electron spin resonance (ESR) techniques to ascertain the redox chemistry occurring with the starting mononuclear R f Mn 2+ –R f TACN complex.Key words: fluorous solvents, biphasic catalysis, alkane/alkene oxidation.

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)0.004
metaresearch head score (Gemma)0.002
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow), Research integrity
Consensus categoriesMeta-epidemiology (narrow), Research integrity
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 score0.015
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0040.002
Meta-epidemiology (narrow)0.0020.002
Meta-epidemiology (broad)0.0030.001
Bibliometrics0.0010.002
Science and technology studies0.0010.002
Scholarly communication0.0000.001
Open science0.0020.000
Research integrity0.0020.003
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 head0.019
GPT teacher head0.267
Teacher spread0.248 · 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; both teacher heads agree on what is shown here.

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

Citations29
Published2001
Admission routes1
Has abstractyes

Explore more

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