Barber, Thomas James
ORCID: 0009-0003-4487-8966
(2026)
Factors Influencing the Crystallinity and Structure of Sodium Lauroyl Isethionate.
Integrated PhD and Master thesis, University of Leeds.
Abstract
Sodium cocoyl isethionate (SCI) is an anionic surfactant widely employed as a foaming and cleansing agent in cosmetic formulations. It comprises a polar sulphonate headgroup connected through an ethyl spacer and ester linkage to an alkyl chain containing 8–18 carbon atoms. Sodium lauroyl isethionate (SLI) was selected as a model compound because its C12 chain is the predominant chain length in commercially manufactured SCI. This research investigated the physicochemical and structural changes occurring in SLI during high-temperature processing and subsequent storage. Static and dynamic laboratory-scale processing conditions were combined with thermal, spectroscopic, and crystallographic analyses to improve understanding of the behaviour of synthetic detergents during manufacture.
SLI was synthesised using excess lauric acid (LA) and recrystallised from methanol to an average purity of 98 wt.%. To simulate manufacturing conditions, SLI was isothermally aged under relevent conditions to assess for potental materials changes using thermal and chemical methods. Structural analaysis was also conducted via pXRD and temperature resolved SAXS to examine changes to crystallinity.
The influence of process relevent ageing on hydration was evaluated using dynamic vapour sorption and thermal analysis. Aged material was prepared and compared with unaged material to determine how structural changes may influence moisture sorption.
Finally, binary SLI–LA mixtures were prepared to represent commercial SCI, and a phase diagram was constructed to detail the relationship between blend composition and the thermal and structural properties.
Collectively, these results establish relationships between thermal history, lamellar organisation, hydration, and fatty-acid content in SLI, providing a structural basis for understanding SCI behaviour during manufacture and storage.
Metadata
| Supervisors: | Harbottle, David and Roberts, Kevin and McRobbie, Ian |
|---|---|
| Keywords: | SLI, SCI, Sodium Lauroyl Isethionate, Sodium Cocoyl Isethionate, Sodium Acyl Isethionate, Isethionate, Isethionate Ester, Isethionate Surfactant, Lauric Acid, LA, Dodecanoic Acid, Fatty Acid, Anionic Surfactant, Amphiphilic Surfactant, Synthetic Detergent, Syndet, Organic Salts, High-Temperature Processing, Isothermal Ageing, Isothermal Aging, Thermal Ageing, Thermal History, Post-Synthesis Processing, Batch Processing, Crystallisation, Crystallization, Cooling-Rate Dependence, Melt-Mediated Transformation, Phase Transition, Thermal Stability, Thermotropic Behaviour, Solid-State Transformation, Alkyl-Chain Disordering, Solid-State Chemistry, Crystal Structure, Crystallography, Lamellar Structure, Lamellar Phase, Surfactant Bilayer, Interlamellar Spacing, d-Spacing, Alkyl-Chain Packing, Interchain Ordering, Headgroup Interactions, Sulphonate Headgroup, Molecular Packing, Structural Disorder, Crystallinity, Polymorphism, Phase Behaviour, Binary Phase Diagram, Binary Mixture, Solid Solution, Phase Separation, Fatty Acid–Surfactant Interactions, Hydration, Hydrate Formation, Hydration State, Hygroscopicity, Moisture Sorption, Water Sorption, Water Binding, Sorption Isotherm, Sorption Hysteresis, Dynamic Vapour Sorption, Relative Humidity, Atmospheric Hydration, Dehydration, Solid–Water Interactions, Sulphonate–Water Interactions, Thermal Analysis, Differential Scanning Calorimetry, DSC, Thermogravimetric Analysis, TGA, DVS, Powder X-Ray Diffraction, pXRD, PXRD, Small-Angle X-Ray Scattering, SAXS, Synchrotron SAXS, Temperature-Resolved SAXS, Fourier-Transform Infrared Spectroscopy, FTIR, TGA-FTIR, Mass Spectrometry, MS, Gas Chromatography, GC, Polarised-Light Optical Microscopy, PL-OM, Crystal Morphology, Solvation Modelling, Molecular Modelling |
| Awarding institution: | University of Leeds |
| Academic Units: | The University of Leeds > Faculty of Engineering (Leeds) > School of Chemical and Process Engineering (Leeds) |
| Date Deposited: | 09 Sep 2026 09:08 |
| Last Modified: | 09 Sep 2026 09:08 |
| Open Archives Initiative ID (OAI ID): | oai:etheses.whiterose.ac.uk:39240 |
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Description: Factors Influencing the Crystallinity and Structure of Sodium Lauroyl Isethionate
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