2-Chlor-4a,5,8,8a-tetrahydro-5,8-methano-naphthalindion-(1,4) | 91063-84-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-Chlor-4a,5,8,8a-tetrahydro-5,8-methano-naphthalindion-(1,4)
• 英文别名: 4-Chlorotricyclo[6.2.1.02,7]undeca-4,9-diene-3,6-dione
• CAS: 91063-84-2
• 化学式: C₁₁H₉ClO₂
• 分子量: 208.644
• InChiKey: LNRANVGBMBSCMY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  14
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  34.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-Chlor-4a,5,8,8a-tetrahydro-5,8-methano-naphthalindion-(1,4) 在 正丁基锂 作用下， 以 四氢呋喃 为溶剂， -78.0~180.0 ℃ 、2.67 kPa 条件下， 反应 0.36h， 生成 2-[4-(1,3-benzodithiol-2-ylidene)-2-chlorocyclohexa-2,5-dien-1-ylidene]-1,3-benzodithiole
  参考文献：
  名称：

  Synthesis and Properties of Tetrathiafulvalene Derivatives Containing Quinoid Structures: Novel Electron Donors of Organic Conductors

  摘要：

  Wittig-Horner reactions of 2-dimethoxyphosphinyl-1,3-dithiole derivatives with a benzoquinone-cyclopentadiene adduct and anthraquinone afforded new types of electron donors with alkylthio groups for organic conductors which showed reversible oxidation waves on cyclic voltammetries and formed conductive charge-transfer complexes with TCNQ or DDQ.

  DOI：

  10.3987/com-94-6802

文献信息

• Saito Katsuhiro, Sugiura Chikayuki, Tanimoto Emi, Saito Katsushi, Yamashi+, Heterocycles, 38 (1994) N 10, S 2153-2158
  作者：Saito Katsuhiro, Sugiura Chikayuki, Tanimoto Emi, Saito Katsushi, Yamashi+

  DOI：——

  日期：——
• Synthesis and Properties of Tetrathiafulvalene Derivatives Containing Quinoid Structures: Novel Electron Donors of Organic Conductors
  作者：Katsuhiro Saito、Chikayuki Sugiura、Emi Tanimoto、Katsushi Saito、Yoshiro Yamashita

  DOI：10.3987/com-94-6802

  日期：——

  Wittig-Horner reactions of 2-dimethoxyphosphinyl-1,3-dithiole derivatives with a benzoquinone-cyclopentadiene adduct and anthraquinone afforded new types of electron donors with alkylthio groups for organic conductors which showed reversible oxidation waves on cyclic voltammetries and formed conductive charge-transfer complexes with TCNQ or DDQ.