Thioacetic acid S-{2-[2-(2-trityloxy-ethoxy)-ethoxy]-ethyl} ester | 223611-35-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 三苯基化合物
• 英文名称: Thioacetic acid S-{2-[2-(2-trityloxy-ethoxy)-ethoxy]-ethyl} ester
• CAS: 223611-35-6
• 化学式: C₂₇H₃₀O₄S
• 分子量: 450.599
• InChiKey: WOCRYAKXCPKVFM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.31
• 重原子数：
  32.0
• 可旋转键数：
  13.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  44.76
• 氢给体数：
  0.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  Thioacetic acid S-{2-[2-(2-trityloxy-ethoxy)-ethoxy]-ethyl} ester 在 sodium methylate 作用下， 反应 1.0h， 生成
  参考文献：
  名称：

  Dynamic Light Scattering Evidence for a Ligand-Induced Motion between the Two Domains of Glucoamylase G1 ofAspergillus niger with Heterobivalent Substrate Analogues

  摘要：

  Heterobifunctional ligands that bind at the same time to the catalytic domain and to the starch-binding domain of glucoamylase induce a conformational change of the protein, as shown by dynamic light scattering. The ligands consist of acarbose and β-cyclodextrin linked together by oligoethylene glycols of variable length (see the schematic diagram).

  DOI：

  10.1002/(sici)1521-3773(19990401)38:7<974::aid-anie974>3.0.co;2-k
• 作为产物：
  描述：

  ((2-(2-(2-chloroethoxy)ethoxy)ethoxy)methanetriyl)tribenzene 在 sodium iodide 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 5.0h， 生成 Thioacetic acid S-{2-[2-(2-trityloxy-ethoxy)-ethoxy]-ethyl} ester
  参考文献：
  名称：

  Dynamic Light Scattering Evidence for a Ligand-Induced Motion between the Two Domains of Glucoamylase G1 ofAspergillus niger with Heterobivalent Substrate Analogues

  摘要：

  Heterobifunctional ligands that bind at the same time to the catalytic domain and to the starch-binding domain of glucoamylase induce a conformational change of the protein, as shown by dynamic light scattering. The ligands consist of acarbose and β-cyclodextrin linked together by oligoethylene glycols of variable length (see the schematic diagram).

  DOI：

  10.1002/(sici)1521-3773(19990401)38:7<974::aid-anie974>3.0.co;2-k