β-propoxy-carbonylethyltin trichloride | 78190-39-3

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: β-propoxy-carbonylethyltin trichloride
• 英文别名: 2-(n-propoxycarbonyl)ethyltin trichloride；2-propoxycarbonylethyltin trichloride；propyl 3-trichlorostannylpropanoate
• CAS: 78190-39-3
• 化学式: C₆H₁₁Cl₃O₂Sn
• 分子量: 340.221
• InChiKey: IFVBWBVEQWCQFH-UHFFFAOYSA-K

物化性质

• 熔点：
  65-66 °C(Solv: dichloromethane (75-09-2); hexane (110-54-3))
• 沸点：
  313.7±25.0 °C(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.99
• 重原子数：
  12.0
• 可旋转键数：
  5.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  26.3
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  β-propoxy-carbonylethyltin trichloride 、 正丁基亚砜 以 苯 为溶剂， 以84%的产率得到SnCl₃(CH₂CH₂C(O)OC₃H₇)((C₄H₉)2SO)
  参考文献：
  名称：

  Synthesis and characterization of β-alkoxycarbonylethyltin trichloride complexes with dibutylsulfoxide. Crystal structure of CH3CH2OCOCH2CH2SnCl3 · (n-C4H9)2SO

  摘要：

  The organotin(IV) complexes, ROCOCH2CH2SnCl3 . nL (R = Me, Et, n-Pr, Allyl, n-Bu, i-Bu; n = 1, 2; L = dibutylsulfoxide) have been synthesized and characterized. The spectral data (IR, H-1 and C-13 NMR) indicate that the 1:1 (n = 1) and 1:2 (n = 2) complexes are all hexa-coordinated tin compounds, and the carbonyl oxygen is coordinated to intramolecular tin atom in 1:1 complexes and is free in 1:2 complexes. The crystal structure of EtOCOCH2CH2SnCl3 . L shows that the fin atom adopts a distorted octahedral geometry via the oxygens of dibutylsulfoxide and intramolecular carbonyl group to tin coordination. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0277-5387(97)00378-1
• 作为产物：
  描述：

  盐酸 、 tin 、 丙烯酸正丙酯 以 乙醚 为溶剂， 以55%的产率得到di(2-propoxycarbonylethyl)tin dichloride
  参考文献：
  名称：

  Alcoholysis of (2-methoxycarbonyl)ethyltin compounds

  摘要：

  DOI：

  10.1016/0022-328x(83)85115-8

文献信息

• SYNTHESIS, CRYSTAL STRUCTURE, AND TRANSESTERIFICATION REACTION OF THE β-PROPOXYCARBONYLETHYLTIN TRICHLORIDE COMPLEX WITH DIBENZYLSULFOXIDE
  作者：Laijin Tian、Bin Zhao、Feng Li

  DOI：10.1081/sim-100001939

  日期：2001.3.29

  Synthesis, crystal structure and transesterification reaction of the beta -propoxy-carbonylethyltin trichloride complex with dibenzylsulfoxide have been reported and a possible mechanism for the transesterification has been suggested. A series of the complexes of beta -alkoxycarbonylethyltin trichloride with dibenzylsulfoxide have been synthesized and characterized by means of elemental analyses, IR, and H-1 NMR spectra.
• SYNTHESIS AND CHARACTERIZATION OF ORGANOTIN(IV) COMPLEXES OF N-(2-MERCAPTOPHENYL)-SALICYLALDIMINE
  作者：Laijin Tian、Bin Zhao、Qingsen Yu、Zhicai Shang

  DOI：10.1081/sim-120014296

  日期：2002.9.18

  The organotin(IV) complexes of N-(2-mercaptophenyl)salicylaldimine, ROCOCH2CH2SnClL (L = OC6H4CH=-NC6H4S, R = alkyl), were synthesized by the reaction of 2-alkoxycarbonylethyltin trichlorides with N-(2-mercaptophenyl)salicylaldimine (H2L) in the presence of triethylamine and were characterized by elemental analyses, IR, H-1 NMR spectra and X-ray single crystal diffraction. The structural features of these compounds are discussed.