1-[2-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-octylsulfanyl)-ethyl]-pyrrolidin-2-one | 1158091-26-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯烷类
• 英文名称: 1-[2-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-octylsulfanyl)-ethyl]-pyrrolidin-2-one
• 英文别名: 1-[2-(3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctylsulfanyl)ethyl]pyrrolidin-2-one
• CAS: 1158091-26-9
• 化学式: C₁₄H₁₄F₁₃NOS
• 分子量: 491.316
• InChiKey: FWRSDSURSFDRBJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.3
• 重原子数：
  30
• 可旋转键数：
  10
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.93
• 拓扑面积：
  45.6
• 氢给体数：
  0
• 氢受体数：
  15

文献信息

• SULFUR CONTAINING FLUOROALKYL AMINES AND ISOCYANATES
  申请人：Herzog Axel Hans-Joachim

  公开号：US20090143608A1

  公开（公告）日：2009-06-04

  The present invention provides a method of making sulfur containing fluoroalkyl amines which overcomes the problems previously known methods. Unlike previously known methods, the method of the present invention can achieve higher yields of sulfur containing fluoroalkyl amines without resorting to costly solvents. Furthermore, unlike previously known methods, the method of the present invention can produce oxidized forms of sulfur containing fluoroalkyl amines wherein the sulfur atom thereof is oxidized.

  本发明提供了一种制备含硫氟烷基胺的方法，克服了先前已知方法存在的问题。与先前已知方法不同，本发明的方法可以在不使用昂贵溶剂的情况下实现更高产量的含硫氟烷基胺。此外，与先前已知方法不同，本发明的方法可以产生含硫氟烷基胺的氧化形式，其中其硫原子被氧化。
• Sulfur containing fluoroalkyl amines and isocyanates
  申请人：E. I. du Pont de Nemours and Company

  公开号：EP2662354A2

  公开（公告）日：2013-11-13

  The present invention provides sulfur containing fluoroalkyl amines represented by the formula Rf-Q-S(O)x-C(H)i(CH3)j-(CH2)z+(i-1)-NHR and isocyanate/isothiocyanate derivatives thereof represented by the formula Rf-Q-S(O)x-C(H)i(CH3)j-(CH2)z+(i-1)-N=C=X1 wherein Rf is chosen from a C2-C12 perfluoroalkyl provided that: i) one fluorine atom of the perfluoroalkyl can be optionally replaced by hydrogen, and/or ii) the perfluoro-alkyl can be optionally interrupted by at least one oxygen, methylene, or ethylene; Q is chosen from the group consisting of a C2-C12 hydrocarbylene optionally interrupted by at least one divalent organic group; x is 1 or 2; z is 0 or 1; i is 1 or 2; j is 0 or 1; provided that i+j=2; R is chosen from H or a C1 to C4 alkyl; and X1 is O or S.

  本发明提供由式 Rf-Q-S(O)x-C(H)i(CH3)j-(CH2)z+(i-1)-NHR 表示的含硫氟烷基胺及其由式 Rf-Q-S(O)x-C(H)i( )j-( )z+(i-1)-N=C=X1 表示的异氰酸酯/异硫氰酸酯衍生物，其中 Rf 选自 C2-C12 全氟烷基，条件是： i) 全氟烷基的一个氟原子可任选被氢取代，和/或 ii) 全氟烷基可任选被至少一个氧、亚甲基或亚乙基中断； ii) 全氟烷基的一个氟原子可任选被氢取代，和/或 iii) 全氟烷基的一个氟原子可任选被至少一个氧、亚甲基或亚乙基中断：i) 全氟烷基的一个氟原子可任选被氢取代，和/或 ii) 全氟烷基可任选被至少一个氧、亚甲基或亚乙基打断；Q 选自至少被一个二价有机基团打断的 C2-C12 碳氢基；x 为 1 或 2；z 为 0 或 1；i 为 1 或 2；j 为 0 或 1；条件是 i+j=2；R 选自 H 或 C1 至 C4 烷基；以及 X1 为 O 或 S。
• US8153846B2
  申请人：——

  公开号：US8153846B2

  公开（公告）日：2012-04-10
• [EN] SULFUR CONTAINING FLUOROALKYL AMINES AND ISOCYANATES<br/>[FR] FLUOROALKYLAMINES ET ISOCYANATES CONTENANT DU SOUFRE
  申请人：DU PONT

  公开号：WO2009073592A2

  公开（公告）日：2009-06-11

  The present invention provides fluoroalkyl amines represented by the formula R1-Q-S(O)x-C(H),(CH3)r(CH2)z+(1-1)-NHR and fluoroalkyl isocyanates and isothiocyanates represented by the formula RrQ-S(O)x-C(H)l(CH3)r(CH2)Z+(1-1)-N=C=X1, where x is 1 or 2; z Is 0 or 1; I is 1 or 2 and j is 0 or 1, such that i+j=2; R is chosen from H or a C1 to C4 alkyl and X1 is O or S. Additionally, the invention provides a method for making a sulfur-containing fluoroalkyl amine comprising the steps of (a) reacting a thiol represented by R1-Q-SH with a /V-vinylamide represented by H2C=CH-(CH2)y-NR-C(O)-R to produce an amide intermediate represented by RrQ-S-C(H)1(CH3)J-(CH2)z+(1-1)-NR-C(O)-R; (b) optionally reacting the amide intermediate with an oxidizing agent to produce a sulfur oxide intermediate represented by RrQ-S(O)x-C(H)1(CH3)1-(CH2)z+(1-1)-NR-C(O)-R and (c) subjecting the amide intermediate or the sulfur oxide intermediate to deacylation to produce the sulfur-containing fluoroalkyl amine.