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Merck

341169

Zinc phthalocyanine

Dye content 97 %

Synonym(s):

Phthalocyanine zinc salt

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About This Item

Empirical Formula (Hill Notation):
C32H16N8Zn
CAS Number:
Molecular Weight:
577.91
UNSPSC Code:
12352103
NACRES:
NA.23
PubChem Substance ID:
EC Number:
238-262-5
Beilstein/REAXYS Number:
4121852
MDL number:
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composition

Dye content, 97%

Quality Segment

reaction suitability

reagent type: catalyst
core: zinc

λmax

701 nm

orbital energy

HOMO 5.17 eV (CV), LUMO 3.78 eV (CV)

OPV device performance

ITO/ZnPc:P60 (1:1)/Bphen/Ag

  • Short-circuit current density (Jsc): 11.7 mA/cm2
  • Open-circuit voltage (Voc): 0.54 V
  • Fill Factor (FF): 0.62
  • Power Conversion Efficiency (PCE): 3.9 %

SMILES string

[Zn]1n2c3nc4nc(nc5n1c(nc6nc(nc2c7ccccc37)c8ccccc68)c9ccccc59)c%10ccccc4%10

InChI

1S/C32H16N8.Zn/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H;/q-2;+2

InChI key

PODBBOVVOGJETB-UHFFFAOYSA-N

General description

Zinc (II) phthalocyanine (ZnPc) complexes show photosensitizing properties. Phthalocyanines show significant Π−Π interactions and easy formation of H aggregates.

Application

Zinc phthalocyanine finds general applications in industry (catalysts, photoconductors etc) and biomedical (photodynamic therapy, PDT). ZnPc may be used to photooxidise cyclohexane. A study reports functionalization of polymer membrane with ZnPc.


Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)



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