{"title":"Preparation and Structural Characterization of o-Ethyl Formate Phenylacetic Acid","authors":"Wang Li-hua, Tai Xi-Shi","doi":"10.12783/issn.1544-8053/14/S1/11","DOIUrl":null,"url":null,"abstract":"A new compound, O-ethyl formate phenylacetic acid, was synthesized by one-pot method with homophthalic acid, CH3OH and Ca(ClO4)2·2H2O. The new compound was determined by elemental analysis and single crystal X-Ray diffraction analysis. The o-ethyl formate phenylacetic acid crystallize in monoclinic, space group C2/c with a = 20.908(4) A, b = 5.2154(10) A, c = 20.045(4) A, β = 97.21(3)o, V = 2168.5(7) A3, Z = 1, Dc = 1.104 μg·m–3, μ = 0.064 mm–1, F(000) = 720, and final R1 = 0.1967, wR2 = 0.4907. The title molecules form 1D chained structure by the interaction of intermolecular hydrogen bonds and π-π stacking.","PeriodicalId":17101,"journal":{"name":"Journal of Residuals Science & Technology","volume":"63 1","pages":""},"PeriodicalIF":0.0000,"publicationDate":"2017-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Residuals Science & Technology","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.12783/issn.1544-8053/14/S1/11","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 0
Abstract
A new compound, O-ethyl formate phenylacetic acid, was synthesized by one-pot method with homophthalic acid, CH3OH and Ca(ClO4)2·2H2O. The new compound was determined by elemental analysis and single crystal X-Ray diffraction analysis. The o-ethyl formate phenylacetic acid crystallize in monoclinic, space group C2/c with a = 20.908(4) A, b = 5.2154(10) A, c = 20.045(4) A, β = 97.21(3)o, V = 2168.5(7) A3, Z = 1, Dc = 1.104 μg·m–3, μ = 0.064 mm–1, F(000) = 720, and final R1 = 0.1967, wR2 = 0.4907. The title molecules form 1D chained structure by the interaction of intermolecular hydrogen bonds and π-π stacking.
期刊介绍：
The international Journal of Residuals Science & Technology (JRST) is a blind-refereed quarterly devoted to conscientious analysis and commentary regarding significant environmental sciences-oriented research and technical management of residuals in the environment. The journal provides a forum for scientific investigations addressing contamination within environmental media of air, water, soil, and biota and also offers studies exploring source, fate, transport, and ecological effects of environmental contamination.
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