A variety of minor organobromine compounds are found in nature, but none are biosynthesized or required by mammals. 585-76-2, formula is C7H5BrO2, Name is 3-Bromobenzoic acid. Organobromine compounds have fallen under increased scrutiny for their environmental impact., Reference of 585-76-2.
Wu, Yong-Ling;Yan, Yong;Pan, Tin-Tin;Wang, Dou-dou research published 《 Natural osthole-based ester derivatives as potential fungicidal agents: design, synthesis and quantitative structure-activity relationship (QSAR)》, the research content is summarized as follows. Turning potential natural products into value-added fungicides is a bioactivity-guided mixed synthesis method. Thirty-two osthole based ester derivatives I (R = Me, Ph, 3-ClC6H4, etc.) were designed and synthesized to improve the potential use of the osthole, a natural coumarin pharmacophore. Compound I (R = 3-ClC6H4) showed a high in vitro and in vivo antifungal activity than other derivatives The preliminary structure-activity relationships (SARs) demonstrated that compounds with a short aliphatic chain or electron-withdrawing groups on Ph ring would have more desirable potency. Meanwhile, the quant. structure-activity relationship (QSAR) model (R2 = 0.928, F = 83.54, S2 = 0.0042) were performed using Gaussian and CODESSA software with optimal conformers and heuristic regression anal., which revealed a correlation of antifungal activity and mol. structures. Thus, these results laid the foundation for further design of improved crop-protection agents based on osthole scaffold.
585-76-2, 3-bromobenzoic acid is a bromobenzoic acid carrying a single bromo subsituent at the 3-position.
3-Bromobenzoic acid, also known as 3-Bromobenzoic acid, is a useful research compound. Its molecular formula is C7H5BrO2 and its molecular weight is 201.02 g/mol. The purity is usually 95%.
3-bromobenzoic acid is used as a reagent in the synthesis of deoxypodophyllotoxin derivatives with insecticidal activity. Also used as a reagent in the synthesis of thiazole derivatives with antibacterial activity.
3-bromobenzoic acid is a molecule that is classified as a Group P2. It has an electronegativity of 1.3 and an acidity of 0.8, which are both in the middle range of values for this group. 3-Bromobenzoic acid is soluble in water and is soluble in ethanol, acetone, and ether. The chemical structure of 3-bromobenzoic acid can be determined by its monoclonal antibody binding sites, electrochemical impedance spectroscopy data, and Langmuir adsorption isotherm data. 3-Bromobenzoic acid reacts with hydrochloric acid to form benzoate and HCl gas. Chronic exposure to 3-bromobenzoic acid has been shown to cause glutamate dehydrogenase inhibition, leading to an accumulation of p-hydroxybenzoic acid in the body. , Reference of 585-76-2
Referemce:
Bromide – Wikipedia,
bromide – Wiktionary