CAS 1093468-95-1 SMDPPEH - Materials / Alfa Chemistry

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Organic Solar Cell (OPV) Materials

SMDPPEH

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Catalog Number

ACM1093468951-1

Product Name

SMDPPEH

Structure

CAS

1093468-95-1

Category

Organic Solar Cell (OPV) Materials

Synonyms

2,5-Di-(2-ethylhexyl)-3,6-bis-(5''-n-hexyl-[2,2',5',2'']terthiophen-5-yl)-pyrrolo[3,4-c]pyrrole-1,4-dione

IUPAC Name

2,5-bis(2-ethylhexyl)-1,4-bis[5-[5-(5-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]pyrrolo[3,4-c]pyrrole-3,6-dione

Molecular Weight

1021.59

Molecular Formula

C58H72N2O2S6

Canonical SMILES

CCCCCCC1=CC=C(S1)C2=CC=C(S2)C3=CC=C(S3)C4=C5C(=C(N(C5=O)CC(CC)CCCC)C6=CC=C(S6)C7=CC=C(S7)C8=CC=C(S8)CCCCCC)C(=O)N4CC(CC)CCCC

InChI

InChI=1S/C58H72N2O2S6/c1-7-13-17-19-23-41-25-27-43(63-41)45-29-31-47(65-45)49-33-35-51(67-49)55-53-54(58(62)59(55)37-39(11-5)21-15-9-3)56(60(57(53)61)38-40(12-6)22-16-10-4)52-36-34-50(68-52)48-32-30-46(66-48)44-28-26-42(64-44)24-20-18-14-8-2/h25-36,39-40H,7-24,37-38H2,1-6H3

InChI Key

GLHOKMYMUKAXAC-UHFFFAOYSA-N

Storage

room temp

Complexity

1570

Covalently-Bonded Unit Count

Exact Mass

1020.391807g/mol

Form

sublimed,ITO/PEDOT:PSS/SMDPPEH:PC71BM (1:1)/Al• Short-circuit current density (Jsc): 9.2 mA/cm² • Open-circuit voltage (Voc): 0.75 V• Fill Factor (FF): 0.44• Power Conversion Efficiency (PCE): 3 %

Formal Charge

Heavy Atom Count

Monoisotopic Mass

1020.391807g/mol

Packaging

250 mg in glass insert

Rotatable Bond Count

XLogP3

MSDS

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COA

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