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Synthesis and Crystal Structure of 3-(2,4-Dichlorophenyl)- 4-dydroxy-5-cyclohexanyl-△3-dihydrofuran-2-one
作者姓名:赵金浩  周勇  徐旭辉  程敬丽  朱国念
作者单位:College;Agriculture;Biotechnology;Zhejiang;University;Chemical;Engineering;Materials;Science;Technology;
基金项目:Supported by the Natural Science Foundation of Zhejiang Province (2008C21029)
摘    要:The title compound 3-(2,4-dichlorophenyl)-4-dydroxy-3-(2,4-dichlorophenyl)-4- dydroxy-5-cyclohexanyl-A3-dihydrofuran-2-one 5 has been synthesized by the cyclization of methyl O-(2,4-dichlorophenyl-acetyl)-1-hydroxycyclo-hexane-carboxylate 4, and its crystal structure was determined by single-crystal X-ray diffraction. The crystal belongs to the triclinic system, space group Pi with a = 6.8192(3), b = 10.5053(5), c = 10.5811(5)A,α = 71.681(10), β = 78.905(12), γ = 81.036(12)°, C15H14C1203, Mr = 313.18, V= 702.44(6)A3, Z = 2, De= 1.481 g/cm^3, F(000) = 324,μ = 0.465 mm^-1, S = 1.006, the final R = 0.0331 and wR = 0.1363 for 2505 observed reflections with I 〉 2σ(I) and 183 variable parameters. The crystal analysis shows that the cyclohexene unit of the title compound has a quasi-chair conformation, and a one-dimensional chain structure is formed via the intermolecular hydrogen bond O(1)-H(101)…O(2).

关 键 词:二氯苯基  晶体结构  二氢呋喃  合成  单晶X射线衍射  标题化合物  一维链状结构  分子间氢键
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