(C6H5)3SnC6H4-o-CH3 | 15807-57-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: (C6H5)3SnC6H4-o-CH3
• 英文别名: triphenyl-o-tolyl stannane；Triphenyl-o-tolyl-stannan；(2-Methylphenyl)(triphenyl)stannane；(2-methylphenyl)-triphenylstannane
• CAS: 15807-57-5
• 化学式: C₂₅H₂₂Sn
• 分子量: 441.16
• InChiKey: INXMKJLHEAJIMM-UHFFFAOYSA-N

物化性质

• 熔点：
  165 °C
• 沸点：
  489.6±38.0 °C(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.37
• 重原子数：
  26
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.04
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为反应物：
  描述：

  (C6H5)3SnC6H4-o-CH3 在 HCl 作用下， 生成 三苯基氯化锡
  参考文献：
  名称：

  Gmelin Handbuch der Anorganischen Chemie, Gmelin Handbook: Sn: Org.Verb.2, 1.1.2.15.7, page 408 - 418

  摘要：

  DOI：
• 作为产物：
  描述：

  2-碘代甲苯 、 lithium triphenylstannide 以 乙醚 为溶剂， 以25.3%的产率得到(C6H5)3SnC6H4-o-CH3
  参考文献：
  名称：

  REACTION OF TRIPHENYLTIN-LITHIUM WITH ORGANIC HALIDES

  摘要：

  DOI：

  10.1021/jo01134a012

文献信息

• Gmelin Handbuch der Anorganischen Chemie, Gmelin Handbook: Sn: Org.Verb.2, 1.1.2.15.7, page 408 - 418
  作者：

  DOI：——

  日期：——
• Kipping, F. B., Journal of the Chemical Society
  作者：Kipping, F. B.

  DOI：——

  日期：——
• Tetraaryl-methane analogues in group 14—V. Distortion of tetrahedral geometryin terms of through-space π–π and π–σ interactions andNMR sagging in terms of π–σcharge transfer
  作者：Michael Charissé、Andrea Zickgraf、Heike Stenger、Elmar Bräu、Cristelle Desmarquet、Martin Dräger、Silke Gerstmann、Dainis Dakternieks、James Hook

  DOI：10.1016/s0277-5387(98)00256-3

  日期：1998.11

  44 members of the compound series Ph4-nMRn (M = Si, Ge, Sn, Pb; R = o-, m-, p-Tol: n = 0-4) were synthesized (15 new compounds). The crystal structures of Ph3Sn(o-Tol) and PhSn(o-Tol)(3) were determined and compared to 16 known n structures. Subject to the distance d(M-C), an interplay between through-space pi-pi repulsion and pi-sigma attraction leads to either elongated or compressed tetrahedral geometry. Si-29-, Sn-119- and Pb-307-NMR chemical shifts were determined in solution and in the solid state. Ge-73 chemical shifts were measured only in solution. An upfield or downfield sagging of the chemical shifts along each series is rationalized in terms of a pi-sigma* charge transfer which is constrained by torsion of the aromatic groups. (C) 1998 Elsevier Science Ltd. All rights reserved.
• Kipping, Journal of the Chemical Society, 1928, p. 2370
  作者：Kipping

  DOI：——

  日期：——
• REACTION OF TRIPHENYLTIN-LITHIUM WITH ORGANIC HALIDES
  作者：HENRY GILMAN、SANDERS D. ROSENBERG

  DOI：10.1021/jo01134a012

  日期：1953.6