1-环己基-3-氮杂啶醇 | 13156-01-9

• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: 1-环己基-3-氮杂啶醇
• 英文名称: 1-cyclohexyl-azetidin-3-ol
• 英文别名: 1-cyclohexyl-3-azetidinol；1-Cyclohexyl-azetidinol-(3)；3-Azetidinol, 1-cyclohexyl-；1-cyclohexylazetidin-3-ol
• CAS: 13156-01-9
• 化学式: C₉H₁₇NO
• 分子量: 155.24
• InChiKey: GPNSPIGRLLHVCN-UHFFFAOYSA-N

物化性质

• 熔点：
  79-80 °C
• 沸点：
  241.9±33.0 °C(Predicted)
• 密度：
  1.115±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  23.5
• 氢给体数：
  1
• 氢受体数：
  2

安全信息

• 海关编码：
  2933990090

反应信息

• 作为反应物：
  描述：

  1-环己基-3-氮杂啶醇 以31%的产率得到
  参考文献：
  名称：

  Higgins Robert H., Faircloth William J., Baughman Russell G., Eaton Quent+, J. Org. Chem, 59 (1994) N 8, S 2172-2178

  摘要：

  DOI：
• 作为产物：
  描述：

  1-氯-3-环己基氨基丙烷-2-醇 在 sodium methylate 、 三乙胺 作用下， 以 甲醇 为溶剂， 生成 1-环己基-3-氮杂啶醇
  参考文献：
  名称：

  Higgins, Robert H.; Watson, Monique R.; Faircloth, William J., Journal of Heterocyclic Chemistry, 1988, vol. 25, p. 383 - 387

  摘要：

  DOI：

文献信息

• Fused aromatic oxazepinones, thiazepinones, diazepinones and sulfur
  申请人：A. H. Robins Company, Inc.

  公开号：US04705853A1

  公开（公告）日：1987-11-10

  Aromatic azepinones and thiones having the formula ##STR1## wherein; A is benzene, naphthalene, quinoline or pyridine; B is oxygen or sulfur; E is oxygen, sulfur or ##STR2## n is 1, 2 or 3; Z is an amino or a heterocyclic nitrogen-containing radical; R is hydrogen, loweralkyl, cycloalkyl or phenylloweralkyl; Y is halo, loweralkyl, loweralkoxy, diloweralkylamino, nitro, amino, loweracetylamino, trifluoromethyl, phenyl or phenyl substituted by one to three Y' radicals selected from halo, loweralkyl, loweralkoxy, diloweralkylamino, nitro, amino, loweracylamino or trifluoromethyl; and having antihistaminic utility, a process for the preparation thereof and chemical intermediates therefor are disclosed.

  芳香族氮杂七元酮和硫醚的化学式为##STR1##其中；A为苯、萘、喹啉或吡啶；B为氧或硫；E为氧、硫或##STR2##n为1、2或3；Z为氨基或含氮杂环的基团；R为氢、较低烷基、环烷基或苯基较低烷基；Y为卤素、较低烷基、较低烷氧基、二较低烷基氨基、硝基、氨基、较低乙酰氨基、三氟甲基、苯基或被从卤素、较低烷基、较低烷氧基、二较低烷基氨基、硝基、氨基、较低酰胺基或三氟甲基中选择的一个至三个Y'基团取代的苯基；具有抗组胺作用，公开了其制备方法和化学中间体。
• Intermediates useful in the preparation of fused aromatic oxazepinones,
  申请人：A. H. Robins Company, Inc.

  公开号：US04727152A1

  公开（公告）日：1988-02-23

  Chemical intermediates having the formula: ##STR1## wherein A represents an aromatic or heterocyclic ring system selected from benzene, a naphthalene, a quinoline or a pyridine in any of its four positions, any of the rings systems are optionally substituted by one or two Y radicals selected from the group consisting of halo, loweralkyl, loweralkoxy, diloweralkylamino, nitro or trifluoromethyl; R is selected from the group consisting of loweralkyl, cycloalkyl or phenylloweralkyl wherein phenyl is optionally substituted by one or two radicals selected from halo, loweralkyl, loweralkoxy, nitro or trifluoromethyl; R.sup.4 and R.sup.5 are selected from hydrogen or loweralkyl; n is 1 or 2; X is selected from chlorine, bromine, or fluorine and E is selected from sulfur, oxygen or ##STR2## and chemical intermediates having the formula: ##STR3## wherein A, R, R.sup.4, R.sup.5, E and n are as defined above and Q is selected from the group consisting of ##STR4## wherein R.sup.3 is hydrogen, an acid neutralizing ion or an esterifying radical; with the proviso that when n is 2 and E is oxygen, A is other than phenyl or substituted phenyl. These chemical intermediates are useful in the preparation of oxazepinones, thiazepinones and diazepinones which exhibit antihistaminic activity.

  化学中间体的化学式为：##STR1## 其中A代表苯、萘、喹啉或吡啶中的任意一个芳香或杂环环系，在任何四个位置上选择，任何一个环系都可以选择由卤、低烷基、低烷氧基、二低烷基氨基、硝基或三氟甲基中的一个或两个Y基团取代；R选自低烷基、环烷基或苯基低烷基，其中苯基可以选择由卤、低烷基、低烷氧基、硝基或三氟甲基中的一个或两个基团取代；R.sup.4和R.sup.5选自氢或低烷基；n为1或2；X选择氯、溴或氟，E选择硫、氧或##STR2## 化学中间体的化学式为：##STR3## 其中A、R、R.sup.4、R.sup.5、E和n的定义如上所述，Q选择##STR4## 其中R.sup.3为氢、酸中和离子或酯化基团；但当n为2且E为氧时，A不是苯或取代苯。这些化学中间体在制备具有抗组胺活性的噁唑烷酮、噻唑烷酮和二嗪烷酮方面非常有用。
• Certain 2,5 and 2,5,6-di- and tri-substituted nicotinic acid
  申请人：A. H. Robins Company, Incorporated

  公开号：US04810795A1

  公开（公告）日：1989-03-07

  Aromatic azepinones and thiones having the formula ##STR1## wherein; A is benzene, naphthalene, quinoline or pyridine; B is oxygen or sulfur; ##STR2## E is oxygen, sulfur or n is 1, 2 or 3; Z is an amino or a heterocyclic nitrogen-containing radical; R is hydrogen, loweralkyl, cycloalkyl or phenyl-loweralkyl; Y is halo, loweralkyl, loweralkoxy, diloweralkylamino, nitro, amino, loweracetylamino, trifluoromethyl, phenyl or phenyl substituted by one to three Y' radicals selected from halo, loweralkyl, loweralkoxy, diloweralkylamino, nitro, amino, loweracylamino or trifluoromethyl; and having antihistaminic utility, a process for the preparation thereof and chemical intermediates therefor are disclosed.

  公开了具有以下公式的芳香族氮杂七元酮和硫酮：##STR1## 其中；A为苯，萘，喹啉或吡啶；B为氧或硫；##STR2## E为氧，硫或n为1、2或3；Z为氨基或含氮杂环的杂环基；R为氢，低烷基，环烷基或苯基-低烷基；Y为卤素，低烷基，低烷氧基，二低烷基氨基，硝基，氨基，低乙酰氨基，三氟甲基，苯基或由一到三个Y'基选择的卤素，低烷基，低烷氧基，二低烷基氨基，硝基，氨基，低乙酰氨基或三氟甲基取代的苯基；具有抗组胺作用，公开了其制备方法和化学中间体。
• Multifunctional water-dispersible crosslink agents
  申请人：Stahl Holland B.V.

  公开号：EP0507407A1

  公开（公告）日：1992-10-07

  The invention describes a new type of multi-functional water-dispersible crosslinking agents. These crosslinking agents are products consisting of oligomeric and compounds containing carbodiimide functions and other reactive functional groups. Further the invention describes aqueous dispersions, emulsions or solutions with such crosslinking agents. Finally the invention comprises a process for the preparation of the crosslinking agent according to the invention.

  本发明描述了一种新型多功能水分散性交联剂。这些交联剂是由含有碳二亚胺官能团和其他活性官能团的低聚物和化合物组成的产品。此外，本发明还描述了含有此类交联剂的水性分散体、乳液或溶液。最后，本发明还包括根据本发明制备交联剂的工艺。
• Ring Opening of Azetidinols by Phenols: Regiochemistry and Stereochemistry
  作者：Robert H. Higgins、William J. Faircloth、Russell G. Baughman、Quentin L. Eaton

  DOI：10.1021/jo00087a038

  日期：1994.4

  Ring opening of a series of 1-alkyl- and 1-benzyl-3-azetidinols by 6-bromophenol without added base is reported. Opening of trans-2-methyl- and cis- and trans-2-phenyl-3-azetidinols is highly regioselective, if not regiospecific. The 2-methyl compounds open by cleavage of the N-C4 bond and the 2-phenyl compounds by cleavage of the N-C2 bond in a highly stereoselective, if not stereospecific, manner, which involves inversion of configuration at C2. The results are rationalized in terms of nucleophilic ring opening of the azetidinium ions.