cis-4-tert-Butylcyclohexanecarbonitrile | 15619-19-9

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: cis-4-tert-Butylcyclohexanecarbonitrile
• 英文别名: cis-4-tert.-Butyl-cyclohexancarbonsaeurenitril；cis-4-tert.-Butyl-1-cyan-cyclohexan；cis-4-tert-Butylcyclohexancarbonitril
• CAS: 15619-19-9
• 化学式: C₁₁H₁₉N
• 分子量: 165.279
• InChiKey: UWGIZGGCJCFYKA-AOOOYVTPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.36
• 重原子数：
  12.0
• 可旋转键数：
  0.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.91
• 拓扑面积：
  23.79
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为产物：
  描述：

  1-(1-Cyano-4-tert-butylcyclohexyl)-2-carbomethoxyhydrazine 在 溴 、 sodium methylate 、 碳酸氢钠 作用下， 生成 cis-4-tert-Butylcyclohexanecarbonitrile
  参考文献：
  名称：

  Methyldialkylcyanodiazenecarboxylates as intermediates for transforming aliphatic ketones into nitriles

  摘要：

  DOI：

  10.1021/jo00431a036

文献信息

• 옥소암모늄 염을 이용한 지방족 알데히드에서 나이트릴로의 산화적 전환법
  申请人：INCHEON NATIONAL UNIVERSITY RESEARCH ＆ BUSINESS FOUNDATION 인천대학교 산학협력단(220040217296) BRN ▼121-82-10382

  公开号：KR20190106583A

  公开（公告）日：2019-09-18

  본 발명은 NHOAc를 사용하여 지방족 알데히드(aliphatic benzaldehyde)를 나이트릴(Nitrile)로 옥소암모늄 염을 매개로 한 산화적 전환(oxidative transformation) 방법에 관한 것으로, 화학량론적 양의 옥소암모늄 염을 사용하여 지방족 알데히드에서 나이트릴로의 산화적 전환과 관련된 최적의 반응 조건을 수립함으로써, 고수율의 나이트릴을 선택적으로 수득할 수고, 사용된 옥소암모늄 염은 간단한 방법에 의하여 산화시켜 재사용이 가능하다.

  本发明涉及一种利用NHOAc将脂族苯甲醛氧化成腈的氧化转化方法，其中脂族苯甲醛通过化学计量学量的氧化铵盐转化为腈，通过建立与脂族苯甲醛向腈的氧化转化相关的最佳反应条件，可以选择性地获得高产率的腈，所使用的氧化铵盐可以通过简单方法氧化再利用。
• Oxoammonium salt-mediated oxidative nitriles synthesis from aldehydes with ammonium acetate
  作者：Myeong Jin Kim、Junyoung Mun、Jinho Kim

  DOI：10.1016/j.tetlet.2017.11.002

  日期：2017.12

  nitriles was developed by oxoammonium salt (4-acetamido-2,2,6,6-tetramethylpiperidine-1-oxoammonium tetrafluoroborate) mediated oxidative conversion of aldehydes with NH4OAc. A variety of aliphatic aldehydes as well as benzaldehydes were converted into the corresponding nitriles in high yields. The nitroxyl radical which is the reduced species of the used oxoammonium salt was recovered by simple acid-base

  通过氧铵盐（4-乙酰氨基-2,2,6,6-四甲基哌啶-1-氧代四氟硼酸铵）介导的醛与NH 4 OAc的氧化反应，开发了一种高效且可扩展的腈合成路线。各种脂族醛和苯甲醛均以高收率转化为相应的腈。通过简单的酸碱萃取回收作为用过的氧铵盐的还原物种的硝酰自由基，以进行再循环。
• TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF
  申请人：Babu Srinivasan

  公开号：US20110201593A1

  公开（公告）日：2011-08-18

  The invention provides novel compounds of formula I having the general formula: wherein R 1 , R 2 , R 3 , X and Y are as described herein. Accordingly, the compounds may be provided in pharmaceutically acceptable compositions and used for the treatment of immunological or hyperproliferative disorders.

  本发明提供了具有以下一般式的新化合物I： 其中R1、R2、R3、X和Y如本文所述。因此，这些化合物可以在药学上可接受的组合物中提供，并用于治疗免疫或过度增生性疾病。
• Jackson, W. Roy; Lovel, Craig G., Australian Journal of Chemistry, 1982, vol. 35, # 10, p. 2053 - 2067
  作者：Jackson, W. Roy、Lovel, Craig G.

  DOI：——

  日期：——
• Electrochemical oxidation of ketone acylhydrazones and their hydrogen cyanide adducts in sodium cyanide-methanol. Transformation of ketones to nitriles
  作者：Mitsuhiro Okimoto、Toshiro Chiba

  DOI：10.1021/jo00290a048

  日期：1990.2

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