bis(3-nitrophenyl) glutarate | 130912-21-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚酯
• 英文名称: bis(3-nitrophenyl) glutarate
• 英文别名: Bis(3-nitrophenyl) pentanedioate
• CAS: 130912-21-9
• 化学式: C₁₇H₁₄N₂O₈
• 分子量: 374.307
• InChiKey: MHJFESMNSZYPLI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  27
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  144
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  (1S,3R,5R,6R,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-5-(aminomethyl)-10,15,20,25,30,35-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontane-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecol 、 bis(3-nitrophenyl) glutarate 生成 N,N'-bis[[(1S,3R,5R,6R,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecahydroxy-10,15,20,25,30,35-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontan-5-yl]methyl]pentanediamide
  参考文献：
  名称：

  COATES, JOHN H.;EASTON, CHRISTOPHER J.;VAN, EYK STEPHEN J.;LINCOLN, STEPH+, J. CHEM. SOC. PT 1. PERKIN TRANS. PT 1,(1990) N, C. 2619-2620

  摘要：

  DOI：
• 作为产物：
  描述：

  间硝基苯酚 、 戊二酸 生成 bis(3-nitrophenyl) glutarate
  参考文献：
  名称：

  COATES, JOHN H.;EASTON, CHRISTOPHER J.;VAN, EYK STEPHEN J.;LINCOLN, STEPH+, J. CHEM. SOC. PT 1. PERKIN TRANS. PT 1,(1990) N, C. 2619-2620

  摘要：

  DOI：

文献信息

• A Versatile Synthesis of Linked Cyclodextrins
  作者：Christopher J. Easton、Steven J. van Eyk、Stephen F. Lincoln、Bruce L. May、John Papageorgiou、Michael L. Williams

  DOI：10.1071/c96168

  日期：——

  Reactions of amino-substituted cyclodextrins with bis(3-nitrophenyl) oxalate, malonate, succinate and glutarate, and with diphenyl carbonate, afford a range of linked cyclodextrins. These include α- and β-cyclodextrin dimers, joined by substitution at either C6 or C3, and asymmetric species with a β-cyclodextrin bonded to an a-cyclodextrin and a C3-substituted cyclodextrin attached to a C6-substituted moiety.

  氨基取代的环糊精与双（3-硝基苯基）草酸酯、丙二酸酯、琥珀酸酯和戊二酸酯以及碳酸二苯酯的反应生成了一系列的环糊精、 丙二酸二（3-硝基苯基）草酸盐、丙二酸二（3-硝基苯基 环糊精。其中包括 α- 和 β-环糊精二聚体、 环糊精二聚体，通过 C6 或 C3 取代连接，以及具有 β-环糊精与 a-环糊精结合，C3-取代的环糊精与 C6 环糊精与 C6 取代的分子相连。
• Coates, John H.; Easton, Christopher J.; Eyk, Stephen J. van, Journal of the Chemical Society. Perkin transactions I, 1990, # 9, p. 2619 - 2620
  作者：Coates, John H.、Easton, Christopher J.、Eyk, Stephen J. van、Lincoln, Stephen F.、May, Bruce L.、et al.

  DOI：——

  日期：——
• CYCLODEXTRIN COMPOSITIONS AND METHODS FOR PHARMACEUTICAL AND INDUSTRIAL APPLICATIONS
  申请人：AUSTRALIAN COMMERCIAL RESEARCH & DEVELOPMENT LIMITED

  公开号：EP0518930A1

  公开（公告）日：1992-12-23
• EP0518930A4
  申请人：——

  公开号：EP0518930A4

  公开（公告）日：1993-09-15
• [EN] CYCLODEXTRIN COMPOSITIONS AND METHODS FOR PHARMACEUTICAL AND INDUSTRIAL APPLICATIONS
  申请人：AUSTRALIAN COMMERCIAL RESEARCH & DEVELOPMENT LIMITED

  公开号：WO1991013100A1

  公开（公告）日：1991-09-05

  (EN) Cyclodextrin derivatives and inclusion complexes are provided, as well as intermediates and syntheses for their production. Also provided are methods for designing inclusion complexes to achieve enhanced properties. Pharmaceutical compositions including $i(inter alia), cimetidine, amiodarone, polypeptides and piroxicam are also provided, as well as numerous processes which can employ the cyclodextrin derivates disclosed.(FR) On décrit des dérivés de cyclodextrines et des composés les renfermant, ainsi que des intermédiaires et des synthèses pour leur production. On décrit également des procédés permettant de concevoir des composés afin d'obtenir des propriétés améliorées. L'invention concerne aussi des compositions pharmaceutiques, entre autres la cimétidine, l'amiodarone, les polypeptides et le piroxicame, ainsi que de nombreux procédés dans lesquels on peut utiliser les dérivés de cyclodextrines.