4-[7,7-Bis(2-ethylhexyl)-10-methyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-7-[7,7-dihexyl-10-(7-methyl-2,1,3-benzothiadiazol-4-yl)-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2,1,3-benzothiadiazole;4,7-dibromo-2,1,3-benzothiadiazole;triphenylphosphane

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 4-[7,7-Bis(2-ethylhexyl)-10-methyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-7-[7,7-dihexyl-10-(7-methyl-2,1,3-benzothiadiazol-4-yl)-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2,1,3-benzothiadiazole;4,7-dibromo-2,1,3-benzothiadiazole;triphenylphosphane
• 英文别名: 4-[7,7-bis(2-ethylhexyl)-10-methyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-7-[7,7-dihexyl-10-(7-methyl-2,1,3-benzothiadiazol-4-yl)-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2,1,3-benzothiadiazole;4,7-dibromo-2,1,3-benzothiadiazole;triphenylphosphane
• 化学式: C84H91Br2N6PS7
• 分子量: 1599.9
• InChiKey: MUFMJTWBZSGPRH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  27.91
• 重原子数：
  100
• 可旋转键数：
  28
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  275
• 氢给体数：
  0
• 氢受体数：
  13