1,3-bis(N-tert-butyl-N-(oxylamino))-5-(1'-methyl-1'-[2''-(S)-methylbutoxy]ethyl)benzene | 234430-03-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1,3-bis(N-tert-butyl-N-(oxylamino))-5-(1'-methyl-1'-[2''-(S)-methylbutoxy]ethyl)benzene
• 英文别名: BNO(*)；tert-butyl-[3-[tert-butyl(oxido)amino]-5-[2-[(2S)-2-methylbutoxy]propan-2-yl]phenyl]-oxoazanium
• CAS: 234430-03-6
• 化学式: C₂₂H₃₈N₂O₃
• 分子量: 378.555
• InChiKey: DLTYKZPVEKERSD-INIZCTEOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  27
• 可旋转键数：
  9
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.73
• 拓扑面积：
  55.6
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  manganese(II) hexafluoroacetonylacetonate 、 1,3-bis(N-tert-butyl-N-(oxylamino))-5-(1'-methyl-1'-[2''-(S)-methylbutoxy]ethyl)benzene 以 乙醚 、 正庚烷 为溶剂， 生成 (Mn(hfac)2)*BNO(*)
  参考文献：
  名称：

  A Chiral Molecular Based Metamagnet Prepared from Manganese Ions and a Chiral Triplet Organic Radical as a Bridging Ligand

  摘要：

  Below 5.4 K the one-dimensional polymeric complex made up of manganese(II) hexafluoroacetylacetonate units and bridging bisaminooxylbenzene diradicals (shown in the picture) behaves as a metamagnet. The R-helical chain not only contains an S-configured chiral carbon center, but also an R-configured C2 -symmetric chiral skeleton of the organic ligand.

  DOI：

  10.1002/(sici)1521-3773(19990601)38:11<1601::aid-anie1601>3.0.co;2-#
• 作为产物：
  描述：

  1,3-dibromo-5-{(1'-hydroxy-1'-methyl)ethyl}benzene 在 氢氧化钾 、 叔丁基锂 、 silver(l) oxide 作用下， 以 二氯甲烷 、 二乙二醇二甲醚 为溶剂， 反应 1.0h， 生成 1,3-bis(N-tert-butyl-N-(oxylamino))-5-(1'-methyl-1'-[2''-(S)-methylbutoxy]ethyl)benzene
  参考文献：
  名称：

  A Chiral Molecular Based Metamagnet Prepared from Manganese Ions and a Chiral Triplet Organic Radical as a Bridging Ligand

  摘要：

  Below 5.4 K the one-dimensional polymeric complex made up of manganese(II) hexafluoroacetylacetonate units and bridging bisaminooxylbenzene diradicals (shown in the picture) behaves as a metamagnet. The R-helical chain not only contains an S-configured chiral carbon center, but also an R-configured C2 -symmetric chiral skeleton of the organic ligand.

  DOI：

  10.1002/(sici)1521-3773(19990601)38:11<1601::aid-anie1601>3.0.co;2-#

文献信息

• Field-Induced Ferrimagnetic State in a Molecule-Based Magnet Consisting of a Co^II Ion and a Chiral Triplet Bis(nitroxide) Radical
  作者：Youhei Numata、Katsuya Inoue、Nikolai Baranov、Mohamedally Kurmoo、Koichi Kikuchi

  DOI：10.1021/ja064828i

  日期：2007.8.1

  one-dimensional chains that are packed parallel to each other in the noncentrosymmetric P1 space group. 1 exhibits four magnetic ground states: paramagnetic; antiferromagnetic; forced ferrimagnetic; field-induced metastable ferrimagnetic. In the paramagnetic state (T > 20 K), it presents short-range antiferromagnetic interaction between Co ion and nitroxide radical and has a minimum of chimT value at 220 K. The

  我们介绍了一种新的基于分子的磁体 [Co(hfac)2].BNO* (1)，其中 hfac = 1,1,1,5，的磁特性的合成、晶体结构以及温度和场依赖性， 5,5-六氟乙酰丙酮和 BNO* 是手性三联体双（硝基氧化物），1,3-双（N-叔丁基-N-氧基氨基）-5-1'-甲基-1'-[2''- (S)-甲基丁氧基]乙基}苯。对映异构体纯 BNO 的存在诱导手性一维链的形成，这些链在非中心对称 P1 空间群中相互平行排列。1 表现出四种磁性基态：顺磁性；反铁磁性；强制亚铁磁性；场致亚稳态亚铁磁体。在顺磁性状态下（T > 20 K），它呈现出 Co 离子和氮氧自由基之间的短程反铁磁相互作用，并且在 220 K 时具有最小的 chimT 值。发现在 220-300 K 温度范围内估计的 Weiss 温度为 -89.9 K。在 20 K (TN) 处，建立了反铁磁长程排序。在 4 K < T <
• A Chiral Molecular Based Metamagnet Prepared from Manganese Ions and a Chiral Triplet Organic Radical as a Bridging Ligand
  作者：Hitoshi Kumagai、Katsuya Inoue

  DOI：10.1002/(sici)1521-3773(19990601)38:11<1601::aid-anie1601>3.0.co;2-#

  日期：1999.6

  Below 5.4 K the one-dimensional polymeric complex made up of manganese(II) hexafluoroacetylacetonate units and bridging bisaminooxylbenzene diradicals (shown in the picture) behaves as a metamagnet. The R-helical chain not only contains an S-configured chiral carbon center, but also an R-configured C2 -symmetric chiral skeleton of the organic ligand.