2,6-双(三甲基甲锡烷基)-4,8-双[(2-正辛基十二烷基)氧]苯并[1,2-B:4,5-B']二噻吩 | 1320201-22-6
2,6-双(三甲基甲锡烷基)-4,8-双[(2-正辛基十二烷基)氧]苯并[1,2-B:4,5-B']二噻吩
2,6-Bis(trimethylstannyl)-4,8-bis(2-n-octyldodecyl)oxybenzo1,2-b:4,5-b'dithiophene
1320201-22-6
C56H102O2S2Sn2
1108.9579
名称和标识符
MDL |
MFCD29472510 |
InChIKey |
AZENTBKKKXIGMB-UHFFFAOYSA-N |
Inchi |
1S/C50H84O2S2.6CH3.2Sn/c1-5-9-13-17-21-23-27-31-35-43(33-29-25-19-15-11-7-3)41-51-47-45-37-39-54-50(45)48(46-38-40-53-49(46)47)52-42-44(34-30-26-20-16-12-8-4)36-32-28-24-22-18-14-10-6-2;;;;;;;;/h37-38,43-44H,5-36,41-42H2,1-4H3;6*1H3;; |
SMILES |
[Sn](C([H])([H])[H])(C([H])([H])[H])(C([H])([H])[H])C1=C([H])C2C(=C(C3C([H])=C(SC=3C=2OC([H])([H])C([H])(C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])[Sn](C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H])OC([H])([H])C([H])(C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])S1 |
别名信息
- 中文别名 -
- 2,6-双(三甲基甲锡烷基)-4,8-双[(2-正辛基十二烷基)氧]苯并[1,2-B:4,5-B']二噻吩
- 2,6-双(三甲基甲锡烷基)-4,8-双[(2-正辛基十二烷基)氧]苯并[1,2-<i>b<
- i>']二噻吩
- 英文别名 -
- 2,6-Bis(trimethylstannyl)-4,8-bis[(2-n-octyldodecyl)oxy]benzo[1,2-b:4,5-b']dithiophene
- i>:4,5-<i>b<
- B4488
- (4,8-bis((2-octyldodecyl)oxy)benzo[1,2-b:4,5-b']dithiophene-2,6-diyl)bis(trimethylstannane)
物化性质
计算特性
氢键供体数量 |
0 |
氢键受体数量 |
4 |
可旋转化学键数量 |
40 |
重原子数量 |
62 |
复杂度 |
980 |
拓扑分子极性表面积 |
74.9 |