2,10-(8,16-dihydro-8,16-dioxodibenzo[a,j]perylenediol)bis(dihydrogen phosphate) | 243670-11-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: 2,10-(8,16-dihydro-8,16-dioxodibenzo[a,j]perylenediol)bis(dihydrogen phosphate)
• 英文别名: (9,22-Dioxo-19-phosphonooxy-6-heptacyclo[13.11.1.12,10.03,8.016,21.023,27.014,28]octacosa-1,3(8),4,6,10,12,14(28),15(27),16(21),17,19,23,25-tridecaenyl) dihydrogen phosphate
• CAS: 243670-11-3
• 化学式: C₂₈H₁₆O₁₀P₂
• 分子量: 574.377
• InChiKey: CENKJPRYINEQBB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  40
• 可旋转键数：
  4
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  168
• 氢给体数：
  4
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  4-氯丁酸甲酯 、 2,10-(8,16-dihydro-8,16-dioxodibenzo[a,j]perylenediol)bis(dihydrogen phosphate) 在 sodium methylate 作用下， 以 甲醇 、 二甲基亚砜 为溶剂， 反应 20.0h， 以60%的产率得到dimethyl 4,4'-[2,10-(8,16-dihydro-8,16-dioxodibenzo[a,j]perylene)bis(oxy)]bisbutanoate
  参考文献：
  名称：

  Far-Red Dibenzo[a,j]Perylene-8,16-Dione Dyes as Fluorescent Enzyme Substrates and Tags for Biomolecules

  摘要：

  The synthesis of fluorescent 2,10-derivatives of the title chromophore are described. The substituents contain amino-reactive N-hydroxysuccinimde eater and thiol-reactive iodoacetamide groups for attachment to biomolecules. A phosphate derivative was also prepared as an enzyme substrate.

  DOI：

  10.1080/00397910008087092
• 作为产物：
  描述：

  2,10-dimethoxydibenzo[a,j]perylene-8,16-dione 在 三氯化铝 、 三氯氧磷 作用下， 以 吡啶 、 苯 为溶剂， 反应 2.0h， 生成 2,10-(8,16-dihydro-8,16-dioxodibenzo[a,j]perylenediol)bis(dihydrogen phosphate)
  参考文献：
  名称：

  Far-Red Dibenzo[a,j]Perylene-8,16-Dione Dyes as Fluorescent Enzyme Substrates and Tags for Biomolecules

  摘要：

  The synthesis of fluorescent 2,10-derivatives of the title chromophore are described. The substituents contain amino-reactive N-hydroxysuccinimde eater and thiol-reactive iodoacetamide groups for attachment to biomolecules. A phosphate derivative was also prepared as an enzyme substrate.

  DOI：

  10.1080/00397910008087092

文献信息

• Far-Red Dibenzo[<i>a,j</i>]Perylene-8,16-Dione Dyes as Fluorescent Enzyme Substrates and Tags for Biomolecules
  作者：Leslie W. Deady、Andrew B. Hughes、Indumathy B. Mahadevan、Nurul H. Quazi、Leann M. Tilley

  DOI：10.1080/00397910008087092

  日期：2000.3

  The synthesis of fluorescent 2,10-derivatives of the title chromophore are described. The substituents contain amino-reactive N-hydroxysuccinimde eater and thiol-reactive iodoacetamide groups for attachment to biomolecules. A phosphate derivative was also prepared as an enzyme substrate.