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Merck
CN

900766

6,12-Dihydro-6,6,12,12-tetrakis(4-octylphenyl)-2,8-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)dithieno[2,3-d:2′,3′-d′]-s-indaceno[1,2-b:5,6-b′]dithiophene

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About This Item

Empirical Formula (Hill Notation):
C88H112B2O4S4
CAS Number:
1454835-54-1
Molecular Weight:
1383.71
MDL number:
MFCD31560651
UNSPSC Code:
12352200
NACRES:
NA.23
Assay:
>98%
Form:
solid

Key Documents

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InChI key

QIKMIMQCQNEOFG-UHFFFAOYSA-N

InChI

1S/C88H112B2O4S4/c1-13-17-21-25-29-33-37-61-41-49-65(50-42-61)87(66-51-43-62(44-52-66)38-34-30-26-22-18-14-2)71-57-70-72(58-69(71)79-77(87)81-73(95-79)59-75(97-81)89-91-83(5,6)84(7,8)92-89)88(67-53-45-63(46-54-67)39-35-31-27-23-19-15-3,68-55-47-64(48-56-6

SMILES string

B%13(OC(C(O%13)(C)C)(C)C)c1[s]c2c([s]c3c2C(c6c3cc7c(c6)c8[s]c9c([s]c(c9)B%12OC(C(O%12)(C)C)(C)C)c8C7(c%11ccc(cc%11)CCCCCCCC)c%10ccc(cc%10)CCCCCCCC)(c5ccc(cc5)CCCCCCCC)c4ccc(cc4)CCCCCCCC)c1

assay

>98%

form

solid

storage temp.

2-8°C

Quality Level

100

Related Categories

Application

The product is an indacene monomer that can be used to prepare wide bandgap polymer, poly(6,6,12,12-tetrakis(4-hexylphenyl)-6,12-dihydro-dithieno[2,3-d:2′,3′-d′]-s-indaceno[1,2-b:5,6-b′]dithiophene) (PIDTT), for the development of polymer solar cells (PSCs) and organic thin film transistors (OTFTs).

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKCD8396

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Alkylated indacenodithieno [3, 2-b] thiophene-based all donor ladder-type conjugated polymers for organic thin film transistors
Lu Rimei, et al.
Journal of Material Chemistry C, 6(8), 2004-2009 (2018)
?Benchtop? Biaryl Coupling Using Pd/Cu Cocatalysis: Application to the Synthesis of Conjugated Polymers
Minus, Matthew B, et al.
Organic Letters, 23(8), 2873-2877 (2021)
A wide band gap polymer based on indacenodithieno [3, 2-b] thiophene for high-performance bulk heterojunction polymer solar cells
Lee Woosung and Jung JW
Journal of Material Chemistry A, 5(2), 712-719 (2017)

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