PCE11

For research use only. Not for therapeutic Use.

  • CAT Number: M440084
  • CAS Number: 1644164-62-4
  • Molecular Formula: (C62H88F2N2S5)n
  • Purity: ≥95%
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PffBT4T-2OD (PCE11, CAS 1644164-62-4) is a low band-gap (1.65 eV) semiconducting polymer developed for high-performance organic photovoltaics (OPVs). It has achieved power conversion efficiencies approaching 11%, driven by its high crystallinity, excellent hole mobilities (~10⁻² cm² V⁻¹ s⁻¹), and ability to support thick active layers for enhanced light absorption. The unique positioning of its alkyl side chains governs temperature-dependent aggregation, allowing precise control over polymer crystallization and film morphology. These properties enable optimized donor–acceptor blends with superior charge transport and efficiency. PffBT4T-2OD is a benchmark donor polymer for advancing next-generation, high-efficiency OPV devices.


CAS Number 1644164-62-4
Synonyms

Poly[(5,6-difluoro-2,1,3-benzothiadiazol-4,7-diyl)-alt-(3,3’’’-di(2-octyldodecyl)-2,2’;5’,2’’;5’’,2’’’-quaterthiophen-5,5’’’-diyl)], PffBT4T-2OD

Molecular Formula (C62H88F2N2S5)n
Purity ≥95%
Solubility Chloroform, chlorobenzene, dichlorobenzene
Storage Room Temperature (Recommended in a cool and dark place)
IUPAC Name azane;5,6-difluoro-4-[5-methyl-3-(2-octyldodecyl)thiophen-2-yl]-7-[5-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-4-(2-octyldodecyl)thiophen-2-yl]-2,1,3-benzothiadiazole
InChI InChI=1S/C64H94F2N2S5.H3N/c1-7-11-15-19-23-25-29-33-36-49(35-31-27-21-17-13-9-3)44-51-43-48(6)70-64(51)58-60(66)59(65)57(61-62(58)68-73-67-61)56-46-52(63(72-56)55-42-41-54(71-55)53-40-39-47(5)69-53)45-50(37-32-28-22-18-14-10-4)38-34-30-26-24-20-16-12-8-2;/h39-43,46,49-50H,7-38,44-45H2,1-6H3;1H3
InChIKey ANHYQTSIMXKIIN-UHFFFAOYSA-N
SMILES CCCCCCCCCCC(CCCCCCCC)CC1=C(SC(=C1)C)C2=C(C(=C(C3=NSN=C23)C4=CC(=C(S4)C5=CC=C(S5)C6=CC=C(S6)C)CC(CCCCCCCC)CCCCCCCCCC)F)F.N
HOMO / LUMO HOMO = -5.34 eV, LUMO = -3.69 eV
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