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Merck
CN

901239

1,3-Bis(5-bromo-2-thienyl)-5,7-bis(2-ethylhexyl)-4H,8H-benzo[1,2-c:4,5-c′]dithiophene-4,8-dione

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About This Item

Empirical Formula (Hill Notation):
C34H38Br2O2S4
CAS Number:
Molecular Weight:
766.73
MDL number:
UNSPSC Code:
12352101
NACRES:
NA.23
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InChI

1S/C34H38Br2O2S4/c1-5-9-11-19(7-3)17-23-27-28(24(39-23)18-20(8-4)12-10-6-2)32(38)30-29(31(27)37)33(21-13-15-25(35)40-21)42-34(30)22-14-16-26(36)41-22/h13-16,19-20H,5-12,17-18H2,1-4H3

InChI key

HETICFAGRUKZDA-UHFFFAOYSA-N

SMILES string

[s]1c(ccc1c2[s]c(c4c2C(=O)c5c(c([s]c5CC(CCCC)CC)CC(CCCC)CC)C4=O)c3[s]c(cc3)Br)Br

assay

≥97%

form

powder

Quality Level

Application

1,3-Bis(5-bromo-2-thienyl)-5,7-bis(2-ethylhexyl)-4H,8H-benzo[1,2-c:4,5-c′]dithiophene-4,8-dione (BDD), a strong electron accepting molecule, can be used in the fabrication of non-fullerene polymeric solar cells. It can also be used in the synthesis of a new conjugated polymer, 5,7-bis(2- ethylhexyl)benzo[1,2-c:4,5-c′]dithiophene-4,8-dione (PBDTBDD).

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

Regulatory Information

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High-efficiency non-fullerene polymer solar cell fabricated by a simple process using new conjugated terpolymers
Hoang MH, et al.
Journal of Material Chemistry C, 7(1), 111-118 (2019)
Wenchao Zhao et al.
Journal of the American Chemical Society, 139(21), 7148-7151 (2017-05-18)
A new polymer donor (PBDB-T-SF) and a new small molecule acceptor (IT-4F) for fullerene-free organic solar cells (OSCs) were designed and synthesized. The influences of fluorination on the absorption spectra, molecular energy levels, and charge mobilities of the donor and
Molecular Optimization Enables over 13% Efficiency in Organic Solar Cells.
Zhao W, et al.
Journal of the American Chemical Society, 139(21), 7148-7151 (2017)
Single-junction organic solar cells based on a novel wide-bandgap polymer with efficiency of 9.7%.
Lijun Huo et al.
Advanced materials (Deerfield Beach, Fla.), 27(18), 2938-2944 (2015-04-03)
Design, Application, and Morphology Study of a New Photovoltaic Polymer with Strong Aggregation in Solution State.
Qian D, et al.
Macromolecules, 45(24), 9611-9617 (2012)

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