ANSPh | 1207273-31-1

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: ANSPh
• 英文别名: N,N,N'-trimethyl-N'-(2-phenylsulfanylethyl)propane-1,3-diamine
• CAS: 1207273-31-1
• 化学式: C₁₄H₂₄N₂S
• 分子量: 252.424
• InChiKey: BYHZNKUGIPUQED-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  17
• 可旋转键数：
  8
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  31.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2-氯乙基苯基硫醚 、 三甲基-1,3-丙二胺 在 potassium carbonate 作用下， 以 乙腈 为溶剂， 生成 ANSPh
  参考文献：
  名称：

  Thioether S-ligation in a side-on μ-η²:η2-peroxodicopper(ii) complex

  摘要：

  [(ANS)CuI(CH3CN)]+ 与 O2 反应生成 [{(ANS)CuII}2(μ-η2:η2-O22⁻)]2+，其 O-O 伸缩振动频率为 731 cm⁻¹，通过与全为 N 配体或含 -S(Ph) 基团的类似物进行比较，表明具有 S-硫醚配位作用。这一发现罕见且为侧连 O22⁻ 结合的新现象。

  DOI：

  10.1039/b918616f

文献信息

• [EN] POLYDENTATE LIGANDS AND THEIR COMPLEXES FOR MOLECULAR CATALYSIS<br/>[FR] LIGANDS POLYDENTATES ET LEURS COMPLEXES POUR LA CATALYSE MOLÉCULAIRE
  申请人：LOS ALAMOS NAT SECURITY LLC

  公开号：WO2015191505A1

  公开（公告）日：2015-12-17

  The present invention relates generally to novel achiral and chiral sulfur-, nitrogen- and phosphorus-containing ligands, designated as NNS-type, P(0)NS-type, PNS-type, SNNS-type, SNNP(0)-type, or SNNP-type polydentate ligands and transition metal complexes of these ligands. The catalysts derived from these ligands and transition metal complexes may be used in a wide range of catalytic reactions, including hydrogenation and transfer hydrogenation of unsaturated organic compounds, dehydrogenation of alcohols and boranes, various dehydrogenative couplings, and other catalytic transformations.

  本发明涉及新型的无手性和手性硫、氮和磷含配体，被称为NNS型、P(0)NS型、PNS型、SNNS型、SNNP(0)型或SNNP型多齿配体以及这些配体的过渡金属配合物。从这些配体和过渡金属配合物衍生的催化剂可用于各种催化反应，包括不饱和有机化合物的加氢和转移加氢、醇和硼烷的脱氢、各种脱氢偶联反应以及其他催化转化。
• Polydentate ligands and their complexes for molecular catalysis
  申请人：Triad National Security, LLC

  公开号：US10550139B2

  公开（公告）日：2020-02-04

  Embodiments of the present disclosure relate generally to novel achiral and chiral sulfur-, nitrogen- and phosphorus-containing ligands, designated as NNS-type, P(O)NS-type, PNS-type, SNNS-type, SNNP(O)-type, or SNNP-type polydentate ligands and transition metal complexes of these ligands, including iridium complexes having PNS-type and NNS-type ligands. The catalysts derived from these ligands and transition metal complexes may be used in a wide range of catalytic reactions, including hydrogenation and transfer hydrogenation of unsaturated organic compounds, dehydrogenation of alcohols and boranes, various dehydrogenative couplings, chemoselective hydrogenation of α,β-unsaturated alcohols, and other catalytic transformations.

  本公开的实施方案一般涉及新型非手性和手性含硫、氮和磷配体，即NNS型、P(O)NS型、PNS型、SNNS型、SNNP(O)型或SNNP型多齿配体以及这些配体的过渡金属配合物，包括具有PNS型和NNS型配体的铱配合物。由这些配体和过渡金属配合物衍生的催化剂可用于多种催化反应，包括不饱和有机化合物的氢化和转移氢化、醇和硼烷的脱氢、各种脱氢偶联反应、α,β-不饱和醇的化学选择性氢化以及其他催化转化反应。
• POLYDENTATE LIGANDS AND THEIR COMPLEXES FOR MOLECULAR CATALYSIS
  申请人：Los Alamos National Security, LLC

  公开号：US20170088571A1

  公开（公告）日：2017-03-30

  Embodiments of the present disclosure relate generally to novel achiral and chiral sulfur-, nitrogen- and phosphorus-containing ligands, designated as NNS-type, P(O)NS-type, PNS-type, SNNS-type, SNNP(O)-type, or SNNP-type polydentate ligands and transition metal complexes of these ligands, including iridium complexes having PNS-type and NNS-type ligands. The catalysts derived from these ligands and transition metal complexes may be used in a wide range of catalytic reactions, including hydrogenation and transfer hydrogenation of unsaturated organic compounds, dehydrogenation of alcohols and boranes, various dehydrogenative couplings, chemoselective hydrogenation of α,β-unsaturated alcohols, and other catalytic transformations.
• Thioether S-ligation in a side-on μ-η²:η2-peroxodicopper(ii) complex
  作者：Ga Young Park、Yunho Lee、Dong-Heon Lee、Julia S. Woertink、Amy A. Narducci Sarjeant、Edward I. Solomon、Kenneth D. Karlin

  DOI：10.1039/b918616f

  日期：——

  [(ANS)CuI(CH3CN)]+ reacts with O2 giving [(ANS)CuII}2(μ-η2:η2-O22−)]2+, νO–O = 731 cm−1, shown to possess S-thioether ligation, based on comparisons with analogues having all N-ligands or a –S(Ph) group. The finding is a rare occurrence and new for side-on O22− binding.

  [(ANS)CuI(CH3CN)]+ 与 O2 反应生成 [(ANS)CuII}2(μ-η2:η2-O22⁻)]2+，其 O-O 伸缩振动频率为 731 cm⁻¹，通过与全为 N 配体或含 -S(Ph) 基团的类似物进行比较，表明具有 S-硫醚配位作用。这一发现罕见且为侧连 O22⁻ 结合的新现象。