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B2403

Sigma-Aldrich

苯并 [ b ] 蒽

98%

别名:

2,3-苯并蒽, 并四苯, 稠四苯

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About This Item

经验公式（希尔记法）:
C18H12
CAS号:
92-24-0
分子量:
228.29
Beilstein:
1909299
EC 号:
202-138-9
MDL编号:
MFCD00003702
UNSPSC代码:
12352103
PubChem化学物质编号:
24891648
NACRES:
NA.23

质量水平

100

方案

98%

表单

powder

mp

>300 °C (lit.)

轨道能量

HOMO 5.4 eV 
LUMO 2.7 eV 

OPV设备性能

ITO/PEDOT:PSS/tetracene/C60/BCP/Al

  • Short-circuit current density (Jsc): 7 mA/cm2
  • Open-circuit voltage (Voc): 0.58 V
  • Fill Factor (FF): 0.57
  • Power Conversion Efficiency (PCE): 2.3 %

半导体性质

P-type (mobility=0.4 cm2/V·s)

SMILES字符串

c1ccc2cc3cc4ccccc4cc3cc2c1

InChI

1S/C18H12/c1-2-6-14-10-18-12-16-8-4-3-7-15(16)11-17(18)9-13(14)5-1/h1-12H

InChI key

IFLREYGFSNHWGE-UHFFFAOYSA-N

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相关类别

储存分类代码

11 - Combustible Solids

WGK

WGK 3

闪点(°F)

Not applicable

闪点(°C)

Not applicable

个人防护装备

Eyeshields, Gloves, type N95 (US)

历史批次信息供参考:

分析证书(COA)

Lot/Batch Number
0000359410
0000359411
0000344382
0000344382
0000359410

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Efficient photovoltaic energy conversion in tetracene-C60 based heterojunctions
Chu, C.; et al.
Applied Physics Letters, 86, 243506-243506 (2005)
Hazuki Morisaki et al.
Nature communications, 5, 5400-5400 (2014-11-08)
Organic crystals are likely to have a large degree of structural relaxation near their surfaces because of the weak inter-molecular interactions. The design of organic field-effect transistors requires a detailed knowledge of the surface relaxation as the carriers usually transfer
Thomas C Allison et al.
The journal of physical chemistry. A, 119(46), 11329-11365 (2015-10-21)
In this article, the first-principles prediction of enthalpies of formation is demonstrated for 669 polycyclic aromatic hydrocarbon (PAH) compounds and a number of related functionalized molecules. It is shown that by extrapolating density functional theory calculations to a large basis
A A Toropov et al.
European journal of medicinal chemistry, 43(4), 714-740 (2007-07-17)
Simplified molecular input line entry system (SMILES) has been utilized in constructing quantitative structure-property relationships (QSPR) for octanol/water partition coefficient of vitamins and organic compounds of different classes by optimal descriptors. Statistical characteristics of the best model (vitamins) are the

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