p-tol2BiOSO2C6H4Me-4 | 108858-15-7

• 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: p-tol2BiOSO2C6H4Me-4
• 英文别名: di-p-tolylbismuth 4-methylbenzenesulfonate；Bis(4-methylphenyl)bismuthanyl 4-methylbenzenesulfonate
• CAS: 108858-15-7
• 化学式: C₂₁H₂₁BiO₃S
• 分子量: 562.442
• InChiKey: KOHHWMLNYBOWTF-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  3.12
• 重原子数：
  26.0
• 可旋转键数：
  5.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  43.37
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  p-tol2BiOSO2C6H4Me-4 、 penta(p-tolyl)antimony(V) 以 乙醚 为溶剂， 以97%的产率得到三对甲苯基铋
  参考文献：
  名称：

  摘要：

  Pentaarylantimony Ar3Sb (Ar = Ph, p-Tol) arylates diarylbismuth arylsulfonates Ar2BiOSO2Ar' (Ar' = C6H4Me-4; C6H3Me2-2,4, C6H3Me2-2,5) in ether at 20 degreesC (48 h) to form triarylbismuth in yields of up to 95%. The second reaction product is tetraarylantimony arenesulfonate. The reaction of pentaphenylantimony with phenylbismuth bis(arenesulfonate) PhBi(OSO2Ar')(2) under the same conditions leads to formation of diphenylbismuth arenesulfonate and tetraphenylantimony arenesulfonate in yields of up to 90%.

  DOI：

  10.1023/a:1023463212564
• 作为产物：
  描述：

  三对甲苯基铋 、 三氧化硫 生成 p-tol2BiOSO2C6H4Me-4
  参考文献：
  名称：

  DEACON, G. B.;FELDER, P. W.;DOMAGALA, M.;HUBER, F.;RUETHER, R., INORG. CHIM. ACTA, 1986, 113, N 1, 43-46

  摘要：

  DOI：

文献信息

• Synthesis of arylbismuth(III) sulfonates from triarylbismuth compounds and arenesulfonic acids or sulfur trioxide
  作者：G.B. Deacon、P.W. Felder、M. Domagala、F. Huber、R. Rüther

  DOI：10.1016/s0020-1693(00)86855-3

  日期：1986.3

  Ph2BiO3SPh (not Ph3Bi·SO3 as previously indicated [1]) and a mixture of (p-MeC6H4)2BiO3S- p-MeC6H4 and p-MeC6H4Bi(O3S-p-MeC6H4)2 have been obtained. On prolonged standing, Ph2BiO3SR′ (R′ = Ph or p-MeC6H4) compounds decompose into BiO(O3SR′) and a small amount of triphenylbismuth.

  三苯甲基和三对甲苯基铋与适当的芳烃磺酸的反应生成二芳基铋（III）磺酸盐，R 2 BiO 3 SR'（R，R'= Ph或p -MeC 6 H 4）。（p -MeC 6 H 4）3 Bi在更苛刻的条件下与PhSO 3 H（摩尔比，1：2）反应，得到不纯的p -MeC 6 H 4 Bi（O 3 SPh）2。来自双变蛋白与三氧化硫的反应，Ph 2 BiO 3 SPh（不是Ph 3如前所述[1]）的Bi·SO 3和（p -MeC 6 H 4）2 BiO 3 S- p -MeC 6 H 4和p -MeC 6 H 4 Bi（O3S- p -MeC 6 H 4）已经获得2。长时间放置后，Ph 2 BiO 3 SR'（R'= Ph或p -MeC 6 H 4）化合物分解为BiO（O 3 SR'）和少量三苯铋。
• ——
  作者：V. V. Sharutin、I. V. Egorova、I. I. Pavlushkina、A. P. Pakusina、N. V. Nasonova、M. A. Pushilin、A. V. Gerasimenko、E. A. Gerasimenko、A. S. Sergienko

  DOI：10.1023/a:1022325831721

  日期：——

  mu-Oxo-bis[(4-methylbenzenesulfonato)triphenylantimony] (I) and mu-oxo-bis[(2,5-dimethylbenzenesulfonato)triphenylantimony] (II) were synthesized by reacting triphenylstibine Ph3Sb with tri-p-tolylbismuth bis(4-methylbenzenesulfonate) and tri-p-tolylbismuth bis(2,5-dimethylbenzenesulfonate), respectively, in toluene in the presence of air moisture. According yo X-ray diffraction data, the antimony atoms in the compounds synthesized have a distorted trigonal bipyramidal configuration. The SbOSb angles are equal to 138.5(2)degrees and 180degrees, respectively. A bent molecule I contains the Sb(1)Sb-...(2) (3.690(1) Angstrom) and (SbS)-S-...(1,2) (3.521(2), 3.559(2) Angstrom) intramolecular contacts. In a linear molecule II, the Sb...S distances are equal to 3.438(1) Angstrom.