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Record W2085024366 · doi:10.1139/v01-151

Attempted enantiotopic group selective cyanohydrin formation from α-alkoxy aldehydes by double stereodifferentiation

2001· article· en· W2085024366 on OpenAlexfundvenueno aff
Dale E. Ward, Marcelo Magalhães Sales, Matthew J. Hrapchak

Bibliographic record

VenueCanadian Journal of Chemistry · 2001
Typearticle
Languageen
FieldChemistry
TopicAsymmetric Synthesis and Catalysis
Canadian institutionsnot available
FundersNatural Sciences and Engineering Research Council of Canada
KeywordsHydrocyanationChemistryCyanohydrinAlkoxy groupReagentSelectivityAdductEnantioselective synthesisKinetic resolutionOrganic chemistryStereochemistryCombinatorial chemistry

Abstract

fetched live from OpenAlex

Enantiotopic group selectivity can result from the competition between substrate and reagent double stereodifferentiation. We have examined this approach for enantioselective hydrocyanation of racemic α-alkoxy aldehydes (e.g., 2-(phenylmethoxy)heptanal (1)). Reaction of 1 with TMSCN mediated by chiral nonracemic alkoxy Ti(IV) reagents under conditions known to be reasonably enantioface selective in reactions with achiral aldehydes, proceeded with very low enantiotopic group selectivity (<2:1). It was established that TMSCN can react with Ti(IV) reagents to produce "TiCN" adducts that are capable of hydrocyanation but with low substrate-controlled diastereoselectivity in reactions with 1. The poor enantiotopic group selectivity observed can be rationalized to result from this low diastereoselectivity despite the respectable levels of enantioface selectivity associated with these reagents in hydrocyanation of achiral aldehydes. Highly diastereoselective hydrocyanation of α-alkoxy aldehydes can be achieved with TMSCN in the presence of excess MgBr 2 ·OEt 2 . High diastereoselectivity was also observed using achiral and chiral TiCN adducts in place of TMSCN. Although the putative TiCN adducts obtained from nonracemic alkoxy Ti(IV) reagents are implicated in enantioface selective hydrocyanation, these reagents were not enantiotopic group selective under these conditions and showed no evidence of double stereodifferentiation. The use of nonracemic bisoxazoline ligands for Mg(II) was also ineffective.Key words: cyanohydrin, 2-alkoxyalkanal, double stereodifferentiation, enantiotopic group selective reaction, kinetic resolution.

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)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesInsufficient payload (model declined to judge)
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 score0.061
Threshold uncertainty score0.999

Codex and Gemma teacher scores by category

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 communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0020.000

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 head0.009
GPT teacher head0.191
Teacher spread0.182 · 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

Citations10
Published2001
Admission routes2
Has abstractyes

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