2-(3-hydroxypropyl)anthracene-9,10-dione | 82203-75-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: 2-(3-hydroxypropyl)anthracene-9,10-dione
• CAS: 82203-75-6
• 化学式: C₁₇H₁₄O₃
• 分子量: 266.296
• InChiKey: TZKOJSSTYAOHLD-UHFFFAOYSA-N

物化性质

• 沸点：
  484.6±34.0 °C(Predicted)
• 密度：
  1.293±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.39
• 重原子数：
  20.0
• 可旋转键数：
  3.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  54.37
• 氢给体数：
  1.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  2-(3-hydroxypropyl)anthracene-9,10-dione 在 Zn(N3)2-2 pyr 、 偶氮二异丁腈 、 偶氮二甲酸二异丙酯 、 三正丁基氢锡 、 三苯基膦 作用下， 以 1,4-二氧六环 为溶剂， 反应 47.0h， 生成 1-((2R,4S,5R)-4-(tert-Butyl-diphenyl-silanyloxy)-5-{[3-(9,10-dioxo-9,10-dihydro-anthracen-2-yl)-propylamino]-methyl}-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione
  参考文献：
  名称：

  Amide backbone modifications for antisense oligonucleotides carrying potential intercalating substituents: Influence on the thermodynamic stability of the corresponding duplexes with RNA- and DNA- complements

  摘要：

  The synthesis of the amide dimers 3-5 carrying a potential intercalating substituent on the nitrogen atom of the backbone is presented, together with the incorporation of these modifications into oligonucleotides, the resulting melting temperatures (T-m's) of the corresponding duplexes with RNA- and DNA- complements and a summary of molecular modeling studies. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(97)00318-1
• 作为产物：
  描述：

  2-溴甲基蒽醌 在 sodium periodate 、 四氧化锇 、 偶氮二异丁腈 、 dimethyl sulfide borane 、 N-甲基吗啉氧化物 作用下， 以 四氢呋喃 、 1,4-二氧六环 为溶剂， 反应 84.0h， 生成 2-(3-hydroxypropyl)anthracene-9,10-dione
  参考文献：
  名称：

  Amide backbone modifications for antisense oligonucleotides carrying potential intercalating substituents: Influence on the thermodynamic stability of the corresponding duplexes with RNA- and DNA- complements

  摘要：

  The synthesis of the amide dimers 3-5 carrying a potential intercalating substituent on the nitrogen atom of the backbone is presented, together with the incorporation of these modifications into oligonucleotides, the resulting melting temperatures (T-m's) of the corresponding duplexes with RNA- and DNA- complements and a summary of molecular modeling studies. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(97)00318-1

文献信息

• Amide backbone modifications for antisense oligonucleotides carrying potential intercalating substituents: Influence on the thermodynamic stability of the corresponding duplexes with RNA- and DNA- complements
  作者：Alain De Mesmaeker、Sebastian Wendeborn、Chantal Jouanno、Valérie Fritsch、Romain M. Wolf

  DOI：10.1016/s0960-894x(97)00318-1

  日期：1997.7

  The synthesis of the amide dimers 3-5 carrying a potential intercalating substituent on the nitrogen atom of the backbone is presented, together with the incorporation of these modifications into oligonucleotides, the resulting melting temperatures (T-m's) of the corresponding duplexes with RNA- and DNA- complements and a summary of molecular modeling studies. (C) 1997 Elsevier Science Ltd.