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684503

Sigma-Aldrich

[6, 6]-Pentadeuterophenyl C61 butyric acid methyl ester

99.5%, 99.5 atom % D

Sinónimos:

1-[3-(Methoxycarbonyl)propyl]-1-pentadeuterophenyl-[6.6] C61, 3′-(Phenyl-d5)3′H-cyclopropyl[1, 9] [5, 6] fullerene-C60-Ih-3′-butanoic acid methyl ester, d5-[60]PCBM

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About This Item

Fórmula empírica (notación de Hill):
C72D5H9O2
Número de CAS:
749898-80-4
Peso molecular:
915.91
UNSPSC Code:
12352103
NACRES:
NA.23

description

functionalized fullerene

isotopic purity

99.5 atom % D

assay

99.5%

form

powder

mass shift

M+5

SMILES string

[2H]c1c([2H])c([2H])c(c([2H])c1[2H])C2(CCCC(=O)OC)[C]3=4c5c6c7c8c9c%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)[C]2=48

InChI

1S/C72H14O2/c1-74-11(73)8-5-9-70(10-6-3-2-4-7-10)71-66-58-50-40-30-22-14-12-13-16-20-18(14)26-34-28(20)38-32-24(16)25-17(13)21-19-15(12)23(22)31-37-27(19)35-29(21)39-33(25)43-42(32)52-46(38)56-48(34)54(44(50)36(26)30)62(66)64(56)68-60(52)61-53(43)47(39)57-49(35)55-45(37)51(41(31)40)59(58)67(71)63(55)65(57)69(61)72(68,70)71/h2-4,6-7H,5,8-9H2,1H3/i2D,3D,4D,6D,7D

InChI key

FIGVSQKKPIKBST-QRKCWBMQSA-N

General description

[6,6]-Pentadeuterophenyl C61 butyric acid methyl ester (PC60BM) is a deuterated fullerene that can be used as an acceptor molecule. It has a fullerene as the core and deuterium and benzyl as the attachment. The deuterium atoms facilitate an increase in the quantum efficiency of the electrochemical devices.

Application

PC60BM is a conjugating polymer that can be used as an alternative to the conventionally used PCBM for the organic electronic based applications, which include polymeric solar cells and organic light emitting diodes (OLEDs).

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Certificados de análisis (COA)

Lot/Batch Number
MKBN9169V
MKBJ5250V
MKBH0578V
MKBG2480V
05907CH

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Characterization of poly (p-phenylene vinylene)/methanofullerene blends of polymer solar cells by time-of-flight secondary ion mass spectrometry
Bulle-Lieuwma CWT, et al.
Applied Surface Science, 231(45), 274-277 (2004)
Bulle-Lieuwma, C.,; Van Duren, J. et al.
Applied Surface Science, 274, 231-232 (2004)
Manipulating the crystal structure of a conjugated polymer for efficient sequentially processed organic solar cells
Yi A, et al.
Nanoscale, 10(45), 21052-21061 (2018)
Deuterium isotope effect on bulk heterojunction solar cells. Enhancement of organic photovoltaic performances using monobenzyl substituted deuteriofullerene acceptors
Lu S, et al.
Organic Letters, 15(22), 5674-5677 (2013)

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