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Record W2268139469 · doi:10.1021/acs.langmuir.5b03064

The Cloud Point of Alkyl Ethoxylates and Its Prediction with the Hydrophilic–Lipophilic Difference (HLD) Framework

2015· article· en· W2268139469 on OpenAlexafffund
Silvia Zarate‐Muñoz, Américo Boza Troncoso, Edgar Acosta

Bibliographic record

VenueLangmuir · 2015
Typearticle
Languageen
FieldChemistry
TopicSurfactants and Colloidal Systems
Canadian institutionsUniversity of Toronto
FundersNatural Sciences and Engineering Research Council of Canada
KeywordsCloud pointPulmonary surfactantChemistryAlkylEthylene oxidePartition coefficientCritical micelle concentrationMicelleChromatographyExtraction (chemistry)Organic chemistryAqueous solution

Abstract

fetched live from OpenAlex

The hydrophobicity of surfactants has been described through different concepts used to guide the formulation of surfactant-water (SW) and surfactant-oil-water (SOW) systems. An integrated framework of hydrophobicity indicators could provide a complete tool for surfactant characterization, and insights on how their relationship may influence the overall phase behavior of the system. The hydrophilic-lipophilic difference (HLD) and the characteristic curvature (Cc) parameter, included in the HLD, have been shown to correlate with different hydrophobicity indicators including the hydrophilic-lipophilic balance (HLB), packing factor (Pf), phase inversion temperature (PIT), spontaneous curvature (Ho), surfactant partition (K(o-w)), and the critical micelle concentration (CMC). This work aims to investigate whether the HLD can further describe a concomitant hydrophobicity parameter, the cloud point (CP) of alkyl ethoxylates. After applying group contribution models to calculate the Cc of monodisperse (pure) nonionic alkyl ethoxylates, a linear correlation between the calculated Cc and the CP was observed for pure surfactants with 8 ethylene oxide (EO) units or less. Furthermore, using an apparent equivalent alkane carbon number (EACN) to represent the hydrophobicity of the micelle core, the HLD equation was capable of predicting cloud point temperatures of pure alkyl ethoxylates, typically within 5 °C. Polydisperse surfactants did not follow the linear CP-Cc correlation found for pure surfactants. After treating polydisperse samples using a liquid-liquid extraction procedure used to remove the most hydrophobic components in the mixture, the resulting treated surfactants fell in the correlation line of pure alkyl ethoxylates. A closer look at the partition behavior of these treated surfactants showed that their partition, Cc and cloud point are dominated by the most abundant ethoxymers in the treated surfactant. The HLD also predicted the cloud point depression of treated surfactants with increasing sodium chloride concentration. This work shows how the HLD framework could be extended to predict the behavior of SW systems.

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)0.001
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 score0.003
Threshold uncertainty score0.006

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0000.001
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.001
Bibliometrics0.0010.001
Science and technology studies0.0000.000
Scholarly communication0.0000.001
Open science0.0000.000
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 head0.016
GPT teacher head0.219
Teacher spread0.203 · 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

Citations51
Published2015
Admission routes2
Has abstractyes

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