4-(4-(diphenylamino)phenyl)-4H-phospholo[3,2-b:4,5-b']bithiophene | 1362739-05-6

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 4-(4-(diphenylamino)phenyl)-4H-phospholo[3,2-b:4,5-b']bithiophene
• 英文别名: 4-(3,11-dithia-7-phosphatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-7-yl)-N,N-diphenylaniline
• CAS: 1362739-05-6
• 化学式: C₂₆H₁₈NPS₂
• 分子量: 439.541
• InChiKey: OFBFPAULTCUMQK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7
• 重原子数：
  30
• 可旋转键数：
  4
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  59.7
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4-(4-(diphenylamino)phenyl)-4H-phospholo[3,2-b:4,5-b']bithiophene 在 双氧水 作用下， 以 氯仿 为溶剂， 反应 0.5h， 以0.92 g的产率得到4-(4-(diphenylamino)phenyl)-4H-phospholo[3,2-b:4,5-b']dithiophene 4-oxide
  参考文献：
  名称：

  Charge-Transfer Properties of Lateral Triphenylamine–Dithienophosphole Diads

  摘要：

  Installation of an exocyclic triphenylamine group at the phosphorus center provides access to dithienophosphole materials with lateral charge. transfer (CT) ability. The degree of CT can be significantly manipulated not only via oxidation of the P-center but also surprisingly by alkylation of the 2,6-position of the scaffold.

  DOI：

  10.1021/ol300331f
• 作为产物：
  描述：

  4-(4-(diphenylamino)phenyl)-4H-phospholo[3,2-b:4,5-b']dithiophene 4-oxide 在 dimethyl sulfide borane 、 三乙胺 作用下， 以 乙醚 、 二氯甲烷 为溶剂， 反应 3.0h， 以68%的产率得到4-(4-(diphenylamino)phenyl)-4H-phospholo[3,2-b:4,5-b']bithiophene
  参考文献：
  名称：

  Charge-Transfer Properties of Lateral Triphenylamine–Dithienophosphole Diads

  摘要：

  Installation of an exocyclic triphenylamine group at the phosphorus center provides access to dithienophosphole materials with lateral charge. transfer (CT) ability. The degree of CT can be significantly manipulated not only via oxidation of the P-center but also surprisingly by alkylation of the 2,6-position of the scaffold.

  DOI：

  10.1021/ol300331f

文献信息

• Charge-Transfer Properties of Lateral Triphenylamine–Dithienophosphole Diads
  作者：Chris Jansen Chua、Yi Ren、Thomas Baumgartner

  DOI：10.1021/ol300331f

  日期：2012.3.16

  Installation of an exocyclic triphenylamine group at the phosphorus center provides access to dithienophosphole materials with lateral charge. transfer (CT) ability. The degree of CT can be significantly manipulated not only via oxidation of the P-center but also surprisingly by alkylation of the 2,6-position of the scaffold.