苯基-(5,6,7,8-四氢萘-2-基)甲酮 | 2657-20-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 苯基-(5,6,7,8-四氢萘-2-基)甲酮
• 英文名称: phenyl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone
• 英文别名: phenyl-(5,6,7,8-tetrahydro-[2]naphthyl)-ketone；Phenyl-(5,6,7,8-tetrahydro-[2]naphthyl)-keton；2-Benzoyl-naphthalin-tetrahydrid-(5.6.7.8)；phenyl(5,6,7,8-tetrahydro-2-naphthalenyl)-methanone；Phenyl-5,6,7,8-tetrahydro-2-naphthylketon；Phenyl-keton；Ketone, phenyl 5,6,7,8-tetrahydro-2-naphthyl
• CAS: 2657-20-7
• 化学式: C₁₇H₁₆O
• mdl: MFCD01095869
• 分子量: 236.313
• InChiKey: AVYSSCRQUSIAJT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  18
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.235
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

安全信息

• 海关编码：
  2914399090

反应信息

• 作为反应物：
  描述：

  苯基-(5,6,7,8-四氢萘-2-基)甲酮 在 sulfur 作用下， 生成 2-苯甲酰萘
  参考文献：
  名称：

  Barbot, Bulletin de la Societe Chimique de France, 1930, vol. <4> 47, p. 1314,1318

  摘要：

  DOI：
• 作为产物：
  描述：

  5,6,7,8-tetrahydro-2-naphthalenecarbonyl chloride 在 三氯化铝 、 苯 作用下， 生成 苯基-(5,6,7,8-四氢萘-2-基)甲酮
  参考文献：
  名称：

  Arnold et al., Journal of the American Chemical Society, 1950, vol. 73, p. 4193

  摘要：

  DOI：

文献信息

• Hydrogen bond donor solvents enabled metal and halogen-free Friedel–Crafts acylations with virtually no waste stream
  作者：Guangchang Liu、Bo Xu

  DOI：10.1016/j.tetlet.2018.01.026

  日期：2018.3

  halogen-free Friedel–Crafts acylation protocol with virtually no waste stream generation. We propose a hydrogen bonding donor solvent will form a hydrogen bonding network and may provide significant rate enhancement for Friedel–Crafts reactions. Trifluoroacetic acid is one of the strongest H-bond donor solvents, which is also volatile and can be easily recovered by distillation without need for reaction workup

  我们已经开发了一种无金属，无卤素的Friedel-Crafts酰化方案，几乎没有废物流产生。我们建议氢键供体溶剂将形成氢键网络，并可能显着提高Friedel-Crafts反应的速率。三氟乙酸是最强的氢键供体溶剂之一，它也是易挥发的，可以通过蒸馏容易地回收而无需进行反应后处理。我们的方案是“绿色”的Friedel-Crafts酰化工艺：1）催化剂可以回收再利用；2）使用无卤素的起始原料（羧酸酐或羧酸）；3）无需进行水相反应后处理；4）最少或没有废蒸汽产生。
• γγ-Disubstituted itaconic acids. Part IV. The Stobbe condensation of 6-benzoyltetralin and 2-benzoylnaphthalene with diethyl succinate
  作者：W. I. Awad、F. G. Baddar、F. A. Fouli、S. M. A. Omran、M. I. B. Selim

  DOI：10.1039/j39680000507

  日期：——

  The mixture of cis-(I) and trans-(Ph/CO2Et)-3-ethoxycarbonyl-4-phenyl-4-(6-tetralyl)but-3-enoic acid (VII) has been converted into ethyl 4-acetoxy-5,6,7,8-tetrahydro-1-phenylphenanthrene-2-carboxylate (IIa) and ethyl 4-acetoxy-1-(6-tetralyl)-2-naphthoate (VIIIa). The derived phenolic acids (IIb) and (VIIIb) were converted into methyl 4-methoxy-1-phenylphenanthrene-2-carboxylate (VIc), and 4-methox

  的混合物的顺式- （I）和反式- （PH / CO 2 ET）-3-乙氧羰基-4-苯基-4-（6- tetralyl）丁-3-烯酸（VII）已被转化为乙基4-乙酰氧基5,6,7,8-四氢-1-苯基菲-2-羧酸酯（IIa）和4-乙酰氧基-1-（6-四烯丙基）-2-萘甲酸乙酯（VIIIa）。将衍生的酚酸（IIb）和（VIIIb）转化为4-甲氧基-1-苯基菲-2-羧酸甲酯（VIc）和4-甲氧基-1-（2-萘基）-2-萘甲酸（XIId） ， 分别。后者被脱羧成4-甲氧基-1,2'-联萘基（XIIe）。顺式和反式的酸酐用氯化铝将-3-羧基-4-（6-四烯丙基）-4-苯基丁-3-烯酸异构化成相应的茚基乙酸（Ⅴ）和（XI），然后用乙酸钠在乙酸酐中环化。然后水解和甲基化得到相应的芴酮（IIIc）和（IXc），与通过环化（IIb）和（VIIIb）的甲基醚获得的芴酮相同。环化的顺式（PH / CO 2 ET）
• Quinuclidine derivatives processes for preparing them and their uses as m2 and/or m3 muscarinic receptor inhibitors
  申请人：Guyaux Michel

  公开号：US20050020660A1

  公开（公告）日：2005-01-27

  The invention concerns quinuclidine derivatives of formula I or II wherein the substituents are as defined in the specification, as well as their use as pharmaceuticals. The compounds of the invention_show high affinities for m3 and/or m2 muscarinic receptors and are particularly suited for treating urinary incontinence.

  本发明涉及式I或II的季铵盐衍生物，其中取代基如规范中所定义，以及它们作为药物的用途。本发明的化合物具有高亲和力m3和/或m2胆碱能受体，特别适用于治疗尿失禁。
• Barrera i Costa, Annales de Chimie (Cachan, France), 1949, vol. <12> 4, p. 84,123
  作者：Barrera i Costa

  DOI：——

  日期：——
• Exploring naphthyl-carbohydrazides as inhibitors of influenza A viruses
  作者：Sanmitra Barman、Lei You、Ran Chen、Vlad Codrea、Grace Kago、Ramakrishna Edupuganti、Jon Robertus、Robert M. Krug、Eric V. Anslyn

  DOI：10.1016/j.ejmech.2013.10.063

  日期：2014.1

  A library of hydrazide derivatives was synthesized to target non-structural protein 1 of influenza A virus (NS1) as a means to develop anti-influenza drug leads. The lead compound 3-hydroxy-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]naphthalene-2-carboxamide, which we denoted as "HENC", was identified by its ability to increase the melting temperature of the effector domain (ED) of the NS1 protein, as assayed using differential scanning fluorimetry. A library of HENC analogs was tested for inhibitory effect against influenza A virus replication in MDCK cells. A systematic diversification of HENC revealed the identity of the R group attached to the imine carbon atom significantly influenced the antiviral activity. A phenyl or cyclohexyl at this position yielded the most potent antiviral activity. The phenyl containing compound had antiviral activity similar to that of the active form of oseltamivir (Tamiflu), and had no detectable effect on cell viability. (C) 2013 Elsevier Masson SAS. All rights reserved.