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Natural abundance 17O NMR study of 2- and 4-substituted benzoyl chlorides
Institution:1. Department of Zoology, Wildlife and Fisheries University of Agriculture, Faisalabad, Pakistan;2. Department of Zoology, Government College University Faisalabad, Pakistan;3. Department of Biochemistry and Biotechnology, University of Gujrat, Gujrat, Pakistan;4. Department of Microbiology, Government College University Faisalabad, Pakistan;5. Department of Zoology, College of Science King Saud University, Riyadh 11451, Saudi Arabia;1. College of Biological, Chemical Science and Engineering, Jiaxing University, 118 Jiahang Road, Jiaxing 314001, China;2. Department of Chemistry, Fudan University, 2005 Songhu Road, Shanghai 200438, China;3. State Key Laboratory of Organometallic Chemistry, Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences, 345 Lingling Road, Shanghai 200032, China
Abstract:Natural abundance 17O NMR chemical shift data for 17 ortho and para benzoyl chlorides recorded in acetonitrile at 75°C are reported. 17O NMR data for the para substituted benzoyl chlorides are correlated with 17O NMR data for similarly substituted acetophenones and methyl benzoates. The 17O NMR signals for ortho isomers are downfield (ca 30 ppm) from their para isomers; the downfield shifts are consistent with torsion angle change. The 17O NMR data for the para isomers gave good correlations with σ+ constants and with dual substituent parameters (DSP).
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