7-Ethynyl-1,3-dimethylpurine-2,6-dione | 65288-56-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 咪唑并嘧啶类
• 英文名称: 7-Ethynyl-1,3-dimethylpurine-2,6-dione
• CAS: 65288-56-4
• 化学式: C₉H₈N₄O₂
• 分子量: 204.19
• InChiKey: HVESQEUNWAWTIA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.4
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  58.4
• 氢给体数：
  0
• 氢受体数：
  3

文献信息

• Nonaqueous Electrolyte Solution and Nonaqueous Secondary Battery
  申请人：Asahi Kasei Kabushiki Kaisha

  公开号：US20210344045A1

  公开（公告）日：2021-11-04

  A nonaqueous electrolyte solution is provided comprising a nonaqueous solvent containing acetonitrile at 5 vol % to 95 vol %; a lithium salt; and one or more compounds having a structure satisfying the following conditions 1 to 5: 1. being a condensation polycyclic heterocyclic ring compound, 2. containing a pyrimidine backbone in the condensation polycyclic heterocyclic ring, 3. containing 3 or more nitrogen atoms in the condensation polycyclic heterocyclic ring, 4. containing 5 or more sp2 carbons in the condensation polycyclic heterocyclic ring, and 5. having no hydrogen atoms bonded to the nitrogen atoms in the condensation polycyclic heterocyclic ring.