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Merck

685321

[6,6]-Phenyl-C61 butyric acid butyl ester

>97%

Synonym(s):

1-(3-Butoxycarbonylpropyl)-1-phenyl-[6.6]C61, PCBB, [60]PCB-C4

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About This Item

Empirical Formula (Hill Notation):
C75H20O2
CAS Number:
Molecular Weight:
952.96
UNSPSC Code:
12352103
NACRES:
NA.23
MDL number:
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description

functionalized fullerene

assay

>97%

form

powder

storage temp.

2-8°C

SMILES string

CCCCOC(=O)CCCC2(c1ccccc1)C34c5c6c7c8c9c%10c(c%11c%12c3c%13c5c%14c%15c6c%16c7c%17c9c%18c%19c%10c%20c%11c%21c%12c%22c%13c%23c%14c%24c%15c%25c%16c%26c%17c%18c%27c%28c%19c%20c%29c%21c%30c%22c%23c%31c%24c%32c%25c%26c%27c%33c%28c%29c%30c%31c%32%33)C248

General description

[6,6]-Phenyl-C61 butyric acid butyl ester ([60]PCB-C4) is a fullerene derivative that is used as an acceptor molecule with good field effect mobility in organic electronics. It has a structural similarity to PCBM based fullerene and its aliphatic groups facilitate an increase in its solubility.

Application

[60]PCB-C4 is a conducting polymer, which can be used in a variety of applications such as organic photovoltaic cells (OPVs) and bulk heterojunction (BHJ) solar cells.


pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves



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Articles

Find various photovoltaic and bioscience-based applications of fullerenes.

SWCNTs show promise in FETs, solar cells, and photodetectors due to their ultrafast charge transport mobility.

Solution-processed organic photovoltaic devices (OPVs) have emerged as a promising clean energy generating technology due to their ease of fabrication, potential to enable low-cost manufacturing via printing or coating techniques, and ability to be incorporated onto light weight, flexible substrates.

View All Articles

The Journal of Organic Chemistry, 60, 532-538 (1995)
Polymer BHJ solar cell performance tuning by C60 fullerene derivative alkyl side-chain length
Kastner C, et al.
Journal of Polymer Science. Part B, Polymer Physics, 50(22), 1562-1566 (2012)
Crystalline polymorphs of [6, 6]-phenyl-C61-butyric acid n-butyl ester (PCBNB)
Choi S, et al.
The Journal of Physical Chemistry B, 116(45), 13568-13574 (2012)