New experimental melting properties as access for predicting amino-acid solubility

Yeong Zen Chua, Hoang Tam, Christoph Schick, Dzmitry H. Zaitsau, Christoph Held

RSC Advances · 2018 · 62 citations · 32 references

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Concepts

Abstract

= (569 ± 7) K for glycine. These melting properties were used in the modeling framework PC-SAFT to predict amino-acid solubility in water. The pure-component PC-SAFT parameters and one binary parameter were taken from literature, in which these parameters were fitted to solubility-independent thermodynamic properties such as osmotic coefficients or mixture densities. It was shown that this allowed accurately predicting amino-acid solubility in water over a broad temperature range. The combined methodology of PC-SAFT and FSC proposed in this work opens the door for predicting solubility of molecules that decompose before melting.

References

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