4-(3,4-dihydro-2-naphthalenyl)morpholine | 21403-93-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 4-(3,4-dihydro-2-naphthalenyl)morpholine
• 英文别名: 4-(3,4-dihydronaphthalen-2-yl)morpholine；4-(3,4-dihydro-naphthalen-2-yl)-morpholine；2-Morpholino-3,4-dihydro-naphthalin；3-Morpholino-1,2-dihydro-naphthalin
• CAS: 21403-93-0
• 化学式: C₁₄H₁₇NO
• 分子量: 215.295
• InChiKey: FYDQKRVGVYZNKL-UHFFFAOYSA-N

物化性质

• 沸点：
  360.6±42.0 °C(Predicted)
• 密度：
  1.134±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  16
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  12.5
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  4-(3,4-dihydro-2-naphthalenyl)morpholine 生成 1,3-diphenyl-4,5-dihydro-3H-benzo[e]indazole
  参考文献：
  名称：

  Regioselectivity and specificity in cycloaddition of diphenylnitrilimine

  摘要：

  DOI：

  10.1016/s0040-4039(01)90278-3
• 作为产物：
  描述：

  吗啉 、 β-四氢萘酮 在 montmorillonite K₁₀ Clay 作用下， 反应 0.08h， 以70%的产率得到4-(3,4-dihydro-2-naphthalenyl)morpholine
  参考文献：
  名称：

  Microwave-Induced Montmorillonite-Mediated Facile Synthesis of Enamines

  摘要：

  蒙脱石黏土介导的简单高产率合成方案，在微波条件下合成不同的烯胺，使用次级胺和酮。该方案非常便利，可在温和反应条件下、短时间内高产率地从环状胺与各种羰基化合物中获得烯胺。

  DOI：

  10.14233/ajchem.2020.22169

文献信息

• Base-Promoted Reactions of Dichlorocarbene Adducts of Cyclic Enamines:  A New Route to Annulated Pyrroles
  作者：Alex C. Bissember、Andrew T. Phillis、Martin G. Banwell、Anthony C. Willis

  DOI：10.1021/ol7021774

  日期：2007.12.1

  Treatment of the gem-dihalogenocyclopropanes 1-5 with potassium tert-butoxide or LDA results in the formation of the corresponding and annulated pyrroles 13-17, respectively.

  用叔丁醇钾或LDA处理宝石-二卤代环丙烷1-5，分别形成相应的和环状的吡咯13-17。
• Fusco,R. et al., Gazzetta Chimica Italiana, 1961, vol. 91, p. 933 - 957
  作者：Fusco,R. et al.

  DOI：——

  日期：——
• Fusco,R. et al., Gazzetta Chimica Italiana, 1961, vol. 91, p. 849 - 865
  作者：Fusco,R. et al.

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• The hit-to-lead optimization of 1,2,3,4,4a,9a-hexahydro-1H-xanthenes as glucocorticoid receptor antagonists
  作者：Yan-Hui Zhu、Meng Zhang、Qun-Yi Li、Qing Liu、Jie Zhang、Yun-Yun Yuan、Fa-Jun Nan、Ming-Wei Wang

  DOI：10.1016/j.cclet.2014.03.017

  日期：2014.5

  The structure activity relationship (SAR) study of a 1,2,3,4,4a,9a-hexahydro-1H-xanthene series of selective, human glucocorticoid receptor alpha (hGR alpha) antagonists is reported. Compounds were screened using hydroxyapatite-based GR binding and MMTV-Luc co-transfection reporter gene assays. Four different regions of the scaffold were modified to assess the effects on hGRa antagonism and related potency. Compound 8d exhibits an 8-fold better bioactivity than the original hit 1a, as well as an improved chemical stability, which make it a promising lead for the subsequent optimization. (C) 2014 Ming-Wei Wang. Published by Elsevier B.V. on behalf of Chinese Chemical Society. All rights reserved.
• Migratory Aptitudes of Unsaturated Groups¹
  作者：Werner Herz、Gerald Caple

  DOI：10.1021/jo01030a008

  日期：1964.7