Search

The crystal structures of six novel salts of 4-nitrobenzoic acid — namely, 2-hydroxyethylammonium 4-nitrobenzoate (I), 2-hydroxypropylammonium 4-nitrobenzoate (II), 1-(hydroxymethyl)propylammonium 4-nitrobenzoate (III), 3-hydroxypropylammonium 4-nitrobenzoate (IV), bis-(2-hydroxyethylammonium) 4-nitrobenzoate (V), morpholinium 4-nitrobenzoate (VI) — containing the same anion but different cations have been studied. The ionic forms of I-VI serve as building blocks of the supramolecular architecture, and in crystals they are held together via ionic N-H···O and O-H···O hydrogen bonds. In the crystal packing the building blocks of I-III are self-assembled via N-H...O, O-H···O and C-H...O hydrogen bonds to form the chains which are further consolidated into two-dimensional layers by the same type of interactions. In IV-VI the chain-like structures have been generated by building blocks.

The relationship between the structure and biological activity (toxicity) SAR of the stoichiometric mixtures between anion and cation (or neutral species) proceeded at pH 8.2 from the different amine salts of benzoic, acetic, oxalic, naphthalene carboxylic acids was determined. Their toxicity was determined by using the metamorphosis (transformation) process of the marine invertebrate Hydractinia echinata (Hydrozoa, Cnidaria) from the freely swimming larva to a sessile polyp as a biological test system. The two components of the stoichiometric mixture, the anion and the cation or neutral species react independently, but in a parallel way, the effectiveness of the cation/neutral species being superior. The studied compounds were grouped by their cationic/neutral structure and measured toxicity. All of these series were also characterized by a calculated mean value of the toxicity. The marine organism, Hydractinia echinata was a good and advantageous alternative for the toxicity testing systems with vertebrate.