4,4'-di(phenylene-ethylene)benzenethiol | 174844-47-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯硫酚类
• 英文名称: 4,4'-di(phenylene-ethylene)benzenethiol
• 英文别名: Benzenethiol, 4-[[4-(phenylethynyl)phenyl]ethynyl]-；4-[2-[4-(2-phenylethynyl)phenyl]ethynyl]benzenethiol
• CAS: 174844-47-4
• 化学式: C₂₂H₁₄S
• 分子量: 310.419
• InChiKey: UVXHUNZHXSIMHL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.1
• 重原子数：
  23
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  1
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  、 4,4'-di(phenylene-ethylene)benzenethiol 以 二氯甲烷 为溶剂， 以49%的产率得到
  参考文献：
  名称：

  The Coordination and Structure of a Thiolate-Terminated „Molecular-Scale Wire” Linked to a Triosmium Cluster

  摘要：

  DOI：

  10.1002/(sici)1099-0682(199804)1998:4<429::aid-ejic429>3.0.co;2-5

文献信息

• PREPARATION OF RUBBER REINFORCED WITH GRAPHENE AND CARBON NANOTUBES AND FUNCTIONALIZED ELASTOMERS AND TIRE WITH COMPONENT
  申请人：The Goodyear Tire & Rubber Company

  公开号：US20150299437A1

  公开（公告）日：2015-10-22

  The invention relates to functionalization of diene-based elastomers with end-chain or in-chain functional groups to promote good dispersion of graphene and carbon nanotubes, and enhance strong interaction between elastomers and graphene and carbon nanotubes. This invention also relates to preparation of rubber reinforced with at least one of graphene and carbon nanotubes with functionalized diene-based elastomer and tire with component thereof.
• The Coordination and Structure of a Thiolate-Terminated „Molecular-Scale Wire” Linked to a Triosmium Cluster
  作者：Richard D. Adams、Thomas Barnard、Adam Rawlett、James M. Tour

  DOI：10.1002/(sici)1099-0682(199804)1998:4<429::aid-ejic429>3.0.co;2-5

  日期：1998.4