11-methylbenzo[d]pyreno[4,5-b]furan | 1300655-38-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: 11-methylbenzo[d]pyreno[4,5-b]furan
• 英文别名: 17-Methyl-20-oxahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5(22),6,8(23),9,11,13(21),14(19),15,17-undecaene；17-methyl-20-oxahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5(22),6,8(23),9,11,13(21),14(19),15,17-undecaene
• CAS: 1300655-38-2
• 化学式: C₂₃H₁₄O
• 分子量: 306.364
• InChiKey: PABDFTONWFJHCB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.6
• 重原子数：
  24
• 可旋转键数：
  0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.04
• 拓扑面积：
  13.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  芘-4,5-二酮 、 3-甲基环己酮 在 iron(III) chloride 作用下， 反应 12.0h， 以32%的产率得到11-methylbenzo[d]pyreno[4,5-b]furan
  参考文献：
  名称：

  Synthesis and photochromic properties of benzofuran–phenanthrene and benzofuran–pyrene hybrids

  摘要：

  铁（III）氯催化下，苯并二酮和芘-4,5-二酮与环己酮及其衍生物的缩合反应生成苯并呋喃-苯并二氢萘和苯并呋喃-芘的混合物。

  DOI：

  10.1039/c4ra02435d

文献信息

• Synthesis, Characterization, Self-Assembly, and Physical Properties of 11-Methylbenzo[<i>d</i>]pyreno[4,5-<i>b</i>]furan
  作者：Jinchong Xiao、Bo Yang、Jen It Wong、Yi Liu、Fengxia Wei、Ke Jie Tan、Xue Teng、Yuechao Wu、Ling Huang、Christian Kloc、Freddy Boey、Jan Ma、Hua Zhang、Hui Ying Yang、Qichun Zhang

  DOI：10.1021/ol2008186

  日期：2011.6.17

  Synthesis, structure, and physical properties of a novel 11-methylbenzo[d]pyreno[4,5-b]furan (BPF) and its self-assembly in water have been reported. The performance of nanowire-based films in organic light-emitting diodes is much better than that of the thin film deposited by directly drop-coating BPF molecules in THF solution. SEM study indicates that the well-organized structure (nanowires) is an important factor In enhancing the performance of OLED devices.
• Synthesis and photochromic properties of benzofuran–phenanthrene and benzofuran–pyrene hybrids
  作者：H. Surya Prakash Rao、Satish Vijjapu

  DOI：10.1039/c4ra02435d

  日期：——

  Iron(iii) chloride mediated condensation of phenanthrene-9,10-dione and pyrene-4,5-dione with cyclohexanone and its derivatives furnish benzofuran–phenanthrene and benzofuran–pyrene hybrids.

  铁（III）氯催化下，苯并二酮和芘-4,5-二酮与环己酮及其衍生物的缩合反应生成苯并呋喃-苯并二氢萘和苯并呋喃-芘的混合物。