1-Butyl-3,5-bis(3-sulfanylpropyl)-1,3,5-triazinane-2,4,6-trione

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 三嗪类
• 英文名称: 1-Butyl-3,5-bis(3-sulfanylpropyl)-1,3,5-triazinane-2,4,6-trione
• 英文别名: 1-butyl-3,5-bis(3-sulfanylpropyl)-1,3,5-triazinane-2,4,6-trione
• 化学式: C₁₃H₂₃N₃O₃S₂
• 分子量: 333.5
• InChiKey: INFWOTYRYFMFAD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  21
• 可旋转键数：
  9
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.77
• 拓扑面积：
  62.9
• 氢给体数：
  2
• 氢受体数：
  5

文献信息

• NOVEL DENTAL COMPOSITES SYSTEMS AND METHODS OF MAKING THE SAME AND USING SAME
  申请人：THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE

  公开号：US20150250687A1

  公开（公告）日：2015-09-10

  The invention includes a composition comprising a vinyl sulfone monomer, a thiol monomer, and optionally an isocyanate monomer. The invention further includes a composition comprising a composition comprising the tetra(2-mercapto)silane (SiTSH) monomer and at least one selected from the group consisting of (a) a Michael acceptor, optionally an isocyanate monomer, and optionally at least one catalyst selected from the group consisting of a base, nucleophile, photolabile base, photolabile nucleophile, and mixtures thereof; (b) an ene monomer, and optionally a polymerization photoinitiator. In certain embodiments, once the composition is polymerized, the polymerized system is suitable for use as a dental composite system. In other embodiments, the polymerized system is stable to acidic and basic conditions. In yet other embodiments, the polymerized system forms microparticles. The invention further includes a method of generating a dental polymeric material.

  该发明涉及一种包含乙烯砜单体、巯基单体和可选的异氰酸酯单体的组合物。该发明还涉及一种包含四(2-巯基)硅烷（SiTSH）单体和至少一种选自以下组合的组合物：（a）一种米氏受体，可选的异氰酸酯单体，以及可选的选自碱、亲核试剂、光敏碱、光敏亲核试剂和它们的混合物中至少一种催化剂；（b）烯单体，以及可选的聚合光引发剂。在某些实施方式中，一旦该组合物聚合，聚合系统适合用作牙科复合系统。在其他实施方式中，聚合系统对酸性和碱性条件稳定。在另一些实施方式中，聚合系统形成微粒。该发明还涉及一种生成牙科聚合材料的方法。
• Methods of Mercaptanizing Unsaturated Compounds and Compositions Produced Therefrom
  申请人：CHEVRON PHILLIPS CHEMICAL COMPANY LP

  公开号：US20140131618A1

  公开（公告）日：2014-05-15

  The present invention discloses polythiol compositions containing polythiol molecules having both thiol groups and intermolecular sulfide groups. Processes for producing such polythiol compositions also are described.
• US9700492B2
  申请人：——

  公开号：US9700492B2

  公开（公告）日：2017-07-11
• US9944803B2
  申请人：——

  公开号：US9944803B2

  公开（公告）日：2018-04-17