242-53-5 ((Dinaphtho[2,3-b:2',3'-d]thiophene)

快速询单

结构式：

Dinaphtho[2,3-b:2',3'-d]thiopheneMOL文件

CAS号：

242-53-5

英文名称：

Dinaphtho[2,3-b:2',3'-d]thiophene

分子式：

C₂₀H₁₂S

分子量：

284.374283790588

Dinaphtho[2,3-b:2',3'-d]thiophene(242-53-5)名称与标识符

名称

英文别名：

Dinaphtho[2,3-b:2',3'-d]thiophene;2,3,6,7-Dibenzo-9-thiafluorene;Dinaphtho[2,3-b,2',3-d]thiophene;242-53-5;12-thiapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;SCHEMBL11990859;DTXSID90393034;12-thiapentacyclo[11.8.0.0?,??.0?,?.0??,??]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;YWKFLXFRCZYQCM-UHFFFAOYSA-N;Dinaphtho[2,3-b;2',3-d]thiophene;

标识符

InChIKey：

YWKFLXFRCZYQCM-UHFFFAOYSA-N

Inchi：

1S/C20H12S/c1-3-7-15-11-19-17(9-13(15)5-1)18-10-14-6-2-4-8-16(14)12-20(18)21-19/h1-12H

SMILES：

S1C2C=C3C=CC=CC3=CC=2C2C=C3C=CC=CC3=CC1=2

Dinaphtho[2,3-b:2',3'-d]thiophene(242-53-5)物化性质

实验特性

PSA : 0

计算特性

精确分子量 : 284.06606
氢键供体数量 : 0
氢键受体数量 : 1
可旋转化学键数量 : 0
同位素质量 : 284.066
重原子数量 : 21
复杂度 : 355
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 6.1
拓扑分子极性表面积 : 28.2Å²

Dinaphtho[2,3-b:2',3'-d]thiophene(242-53-5)相关文献

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3. High performance solution-crystallized thin-film transistors based on V-shaped thieno[3,2-f:4,5-f′]bis[1]benzothiophene semiconductors
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4. Band-like transporting and thermally durable V-shaped organic semiconductors with a phenyl key block
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