(2-methylthiophenylazo)-p-toluene | 101418-86-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 偶氮苯
• 英文名称: (2-methylthiophenylazo)-p-toluene
• 英文别名: (4-Methylphenyl)-(2-methylsulfanylphenyl)diazene
• CAS: 101418-86-4
• 化学式: C₁₄H₁₄N₂S
• 分子量: 242.345
• InChiKey: WOIUKYUDBMJKME-UHFFFAOYSA-N

物化性质

• 沸点：
  376.7±25.0 °C(Predicted)
• 密度：
  1.08±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  50
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  sodium tetrachloropalladate(II) 、 (2-methylthiophenylazo)-p-toluene 以 乙醇 为溶剂， 生成 chloro(((2-(methylthio)phenyl)azo)-4'-methylphenyl-C(2'),N,S)palladium(II)
  参考文献：
  名称：

  Mahapatra, Amiya K.; Bandyopadhyay, Debkumar; Bandyopadhyay, Pinaki, Inorganic Chemistry, 1986, vol. 25, # 13, p. 2214 - 2221

  摘要：

  DOI：

文献信息

• Mahapatra, Amiya K.; Datta, Sachchidananda; Goswami, Sreebrata, Inorganic Chemistry, 1986, vol. 25, # 10, p. 1715 - 1721
  作者：Mahapatra, Amiya K.、Datta, Sachchidananda、Goswami, Sreebrata、Mukherjee, Monika、Mukherjee, Alok Kumar、Chakravorty, Animesh

  DOI：——

  日期：——
• Bag; Sinha, Journal of the Indian Chemical Society, 1997, vol. 74, # 10, p. 763 - 764
  作者：Bag、Sinha

  DOI：——

  日期：——
• Platinum(IV)-azobenzene cyclometalation products and related species
  作者：Surajit Chattopadhyay、Chittaranjan Sinha、Partha Basu、Animesh Chakravorty

  DOI：10.1021/om00050a053

  日期：1991.4

  The first platinum(IV) cyclometalates of azobenzene, Pt(IV)(RL)Cl3 (R = H, Me), have been synthesized by oxidation of Pt(II)(RL)Cl by chlorine or m-chloroperbenzoic acid (Pt(RL) = cycloplatinated 2-(methylthio)azobenzene fragment). The X-ray structures of Pt(MeL)Cl3 and Pt(MeL)Cl are reported. In both cases the organic moiety acts as a planar tridentate (C,N,S) ligand and the lattice consists of loose dimers held by nonbonded S...S interactions. The Pt-C distances are equal in the two molecules, but the other metal-ligand distances are longer (e.g., Pt-S by approximately 0.09 angstrom) in Pt(MeL)Cl3. Weakening of back-bonding upon metal oxidation may be one of the reasons. In H-1 NMR spectra, the 3J coupling constant between Pt-196 and H-1(SMe) increases from 12.3 Hz in Pt(MeL)Cl3 to 20.1 Hz in Pt(MeL)Cl, in accord with the increase in 6s character of the metal hybrid orbitals. The complexes Pt(MeL)Cl and Pd(MeL)Cl are isomorphous, with very similar bond parameters. However, chlorine and mCPBA, which oxidize the metal in Pt(RL)Cl, attack the Pd-C bond (in effect the coordinated ligand is attacked) in Pd(RL)Cl, leaving the metal oxidation state unchanged. The reactivity difference corresponds to the nucleophilicity orders Pt(II) >> Pd(II) and Pd-C >> Pt-C. Crystal data for Pt(MeL)Cl3: space group P2(1)/n; a = 7.436 (2) angstrom, b = 18.613 (4) angstrom, c = 12.335 (2) angstrom, beta = 104.66 (2)-degrees; Z = 4, V = 1651.6 (6) angstrom3. Crystal data for Pt(MeL)Cl: space group P1BAR; a = 7.421 (5) angstrom, b = 8.830 (5) angstrom; c = 11.083 (6) angstrom, alpha = 105.44 (4)-degrees, beta = 92.05 (5)-degrees, gamma = 97.16 (5)-degrees; Z = 2, V = 692.7 (7) angstrom3. Crystal data for Pd(MeL)Cl: space group P1BAR; a = 7.424 (3) angstrom, b = 8.833 (4) angstrom, c = 11.127 (4) angstrom, alpha = 105.44 (3)-degrees, beta = 93.26 (3)-degrees, gamma = 96.81 (3)-degrees; Z = 2, V = 695.4 (5) angstrom3.
• Mahapatra, Amiya K.; Bandyopadhyay, Debkumar; Bandyopadhyay, Pinaki, Inorganic Chemistry, 1986, vol. 25, # 13, p. 2214 - 2221
  作者：Mahapatra, Amiya K.、Bandyopadhyay, Debkumar、Bandyopadhyay, Pinaki、Chakravorty, Animesh

  DOI：——

  日期：——