(E)-6-(naphthalen-1-yl)hex-3-en-2-one | 1027210-16-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: (E)-6-(naphthalen-1-yl)hex-3-en-2-one
• 英文别名: (E)-6-naphthalen-1-ylhex-3-en-2-one
• CAS: 1027210-16-7
• 化学式: C₁₆H₁₆O
• 分子量: 224.302
• InChiKey: DZNVRHWYVCLDQM-FARCUNLSSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  17
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.19
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  (E)-6-(naphthalen-1-yl)hex-3-en-2-one 在 palladium on activated charcoal 氢气 作用下， 以 乙醇 为溶剂， 反应 2.0h， 生成 6-(naphthalen-1-yl)hexan-2-one
  参考文献：
  名称：

  Synthesis and DHFR inhibitory activity of a series of 6-substituted-2,4-diaminothieno[2,3-d]pyrimidines

  摘要：

  A series of 6-aralkyl substituted 2,4-diaminothieno[2,3-d]pyrimidines in which the 6-aryl group is separated from the thieno[2,3-d]pyrimidine ring by two to five methylene groups were synthesized and studied as inhibitors of dihydrofolate reductase from Pneumocystis carinii, Toxoplasma gondii, Mycobacterium avium, and rat liver. Compounds in which the thieno[2,3-d]pyrimidine ring is separated from the 6-aryl substituent by three methylene groups were the most potent inhibitors of the series (with IC50 values ranging from 0.24 and 11.0 muM) but those with two methylene groups between the aromatic rings were the most selective agents. (C) 2003 Editions scientifiques et medicales Elsevier SAS. All rights reserved.

  DOI：

  10.1016/s0223-5234(03)00101-6
• 作为产物：
  描述：

  2-(2-Naphthalen-1-ylethyl)-1,3-dioxolane 在 盐酸 、 溶剂黄146 作用下， 以 四氢呋喃 、 氯仿 为溶剂， 反应 52.0h， 生成 (E)-6-(naphthalen-1-yl)hex-3-en-2-one
  参考文献：
  名称：

  Synthesis and DHFR inhibitory activity of a series of 6-substituted-2,4-diaminothieno[2,3-d]pyrimidines

  摘要：

  A series of 6-aralkyl substituted 2,4-diaminothieno[2,3-d]pyrimidines in which the 6-aryl group is separated from the thieno[2,3-d]pyrimidine ring by two to five methylene groups were synthesized and studied as inhibitors of dihydrofolate reductase from Pneumocystis carinii, Toxoplasma gondii, Mycobacterium avium, and rat liver. Compounds in which the thieno[2,3-d]pyrimidine ring is separated from the 6-aryl substituent by three methylene groups were the most potent inhibitors of the series (with IC50 values ranging from 0.24 and 11.0 muM) but those with two methylene groups between the aromatic rings were the most selective agents. (C) 2003 Editions scientifiques et medicales Elsevier SAS. All rights reserved.

  DOI：

  10.1016/s0223-5234(03)00101-6

文献信息

• Dearomative Intramolecular (4+3) Cycloadditions of Arenes with Epoxy and Aziridinyl Enolsilanes
  作者：Jesse Ling、Sarah Lam、Kam-Hung Low、Pauline Chiu

  DOI：10.1002/anie.201704155

  日期：2017.7.17

  enolsilanes with benzene, naphthalene, and anthracene derivatives is reported. Highly functionalized polycyclic alcohols and amines are generated under relatively mild reaction conditions with yields up to 89 %. Optically enriched cycloadducts are obtained from cycloadditions of enantiomerically pure epoxides and aziridines.

  报道了环氧和叠氮基烯醇硅烷与苯，萘和蒽衍生物的分子内（4 + 3）环加成。在相对温和的反应条件下可以生成高度官能化的多环醇和胺，收率高达89％。光学富集的环加合物是从对映体纯的环氧化物和氮丙啶的环加成反应中获得的。