The crystal structure of the title compound, C6H16N2O3
2+·2Cl−, has been reported previously by Palm [Acta Cryst. (1967 ▶), 22, 209–216] from Weisenberg camera data, with R1 = 10.5%, isotropic refinement of non-H atoms and H atoms not located. We remeasured a data set of the title compound and present a more precise structure determination. The asymmetric unit contains two unique 1,3-diammonio-1,2,3-trideoxy-cis-inositol cations and four Cl− counter-ions. The cyclohexane rings of both inositol cations adopt chair conformations with two axial hydroxy groups. An extended network of hydrogen bonds is formed. The four chloride counter ions are hydrogen bonded to the hydroxy and ammonium groups of the cations by N—H⋯Cl and O—H⋯Cl interactions. The cations are aligned into wavy layers by cation⋯cation interactions of the form N—H⋯O(ax), N—H⋯O(eq) and O(ax)—H⋯O(eq). Intramolecular hydrogen bonding between the axial hydroxy groups is, however, not observed.
The crosslink density of elastomers is the essential property that determines many other but especially the mechanical product properties. Different raw materials, especially recycled and bio-based materials, influence the vulcanization and may change the crosslink density when they are used as a substitute to conventional raw materials. Aim of this study is to develop a procedure that allows the reliable determination of the crosslink density in highly filled EPDM compounds as basis for future investigations focussed on substitution with sustainable materials in this compound. Unfortunately, experiences with other rubber compounds like tire treads cannot be directly applied here because of the use of other filler types and amounts as well as the differences in the polymer with regard to active sites (available double bonds). Equilibrium swelling, Flory-stress-strain-measurements, freezing point depression and temperature-scanning-stress-relaxation are applied to a model EPDM compound with high filler and softener amount as typically used for sealings. For sensitivity investigation the amount of the crosslink agent sulfur was varied. Furthermore, the influence of different accelerators was investigated. All methods are able to determine the crosslink density but with different standard deviations due to measurement errors. Partially, they can be optimized for this use case. Based on the results a combination of Flory-stress-strain-measurements and freezing point depression was chosen to be used in the future.
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