Articles with "active butanetriol" as a keyword



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Computational study of Simultaneous synthesis of optically active (RS)-1,2,4-butanetriol trinitrate (BTTN)

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Published in 2017 at "Journal of Molecular Modeling"

DOI: 10.1007/s00894-017-3414-9

Abstract: AbstractIn respective water or ethanol polarizable continuum cavity environments, simultaneous aldol condensation was performed using density functional theory (DFT) computational method to model the synthesis of optically active (RS)-1,2,4-butanetriol trinitrate (BTTN). The results of reaction… read more here.

Keywords: optically active; synthesis optically; active butanetriol; butanetriol trinitrate ... See more keywords