Structure

Cobalt phthalocyanine, 92%

CAS
3317-67-7
Catalog Number
ACM3317677
Category
Photonic and Optical Device
Molecular Weight
571
Molecular Formula
C32H16CoN8

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Specification

Synonyms
Phthalocyanine Cobalt(II)
IUPAC Name
cobalt(2+);2,11,20,29,37,39-hexaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene;
Canonical SMILES
C1=CC=C2C(=C1)C3=NC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=N7)N=C2[N-]3)C9=CC=CC=C94.[Co+2];
InChI
InChI=1S/C32H16N8.Co/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
MPMSMUBQXQALQI-UHFFFAOYSA-N
Melting Point
480 ℃
Application
Cobalt phthalocynine (CoPc) is a member of metal phthalocyanines (MPcs) are frequently used in many organic electronic devices such as light-emitting diodes (LEDs), organic photovoltaics (OPVs), organic field-effect transistors (OFETs) and chemical sensors as a p-type semiconducting material. Compared to other hole-injection layer (HIL) materials, most metal phthalocyanines are water and air stable, thermally stable, and nontoxic. They can be sublimed or sputtered with highly uniform, thin films on a variety of substrates. The synthesis of such materials are also relatively inexpensive and easy to prepare. The chemical structure of MPc allows tuning of its ionisation potential or HOMO levels by altering the central atom in Pc macrocycles.

Using cobalt phthalocyanine (CoPc) layer as a hole-injection layer (HIL), remarkable improvements in turn-on voltage and luminance have been observed in organic light-emitting diodes (OLED) [1, 2, 3, 4]. The driving voltages of the MPc electroluminance devices are found to decrease in the order of:

ZnPcwhich is in agreement with the order of HOMO levels of MPcs.
Complexity
1080
Covalently-Bonded Unit Count
2
EC Number
222-012-7
Exact Mass
571.083g/mol
Hazard Statements
H351
H-Bond Acceptor
4
Heavy Atom Count
41
MDL Number
MFCD00010718
Monoisotopic Mass
571.083g/mol
Precautionary Statements
P281
Signal Word
Warning
Topological Polar Surface Area
76.2A^2
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