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Cobalt phthalocyanine

CAT: 0804-HY-18761-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0804-HY-18761-01Size:1 g
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Description
Cobalt phthalocyanine is a catalyst of redox reaction, catalyzes aerobic regenerations of aldehydes and ketones from aldoximes and ketoximes. Cobalt phthalocyanine can be used in the development of electrocatalysts[1][2].
CAS Number
3317-67-7
Product Name Alternative
Cobalt (II) phthalocyanine; Cobaltous phthalocyanine; Phthalocyanine cobalt complex
UNSPSC
12352300
Hazard Statement
H351
Target
Biochemical Assay Reagents
Type
Reference compound
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/Cobalt-phthalocyanine.html
Purity
98.0
Solubility
DMSO : < 1 mg/mL (ultrasonic; warming; heat to 60°C)
Smiles
[N-]12[Co+2]34[N-]5C6=NC(C7=CC=CC=C87)=[N]3C8=NC1=C(C=CC=C9)C9=C2N=C%10[N]4=C(C%11=CC=CC=C%10%11)N=C5C%12=CC=CC=C6%12
Molecular Formula
C32H16CoN8
Molecular Weight
571.46
Precautions
H351
References & Citations
[1]Ahmad S, et al. Cobalt (II) phthalocyanine catalyzed aerobic regeneration of carbonyl compounds from the corresponding oximes in 1-butyl-3-methylimidazolium bromide. Applied Catalysis A: General. 2009 Dec, 371 (1-2) : 148-152.|[2]Reis RM, et al. The use of copper and cobalt phthalocyanines as electrocatalysts for the oxygen reduction reaction in acid medium[J]. Electrochimica Acta, 2014, 139: 1-6. |[3]Wang M, et al. CO2 electrochemical catalytic reduction with a highly active cobalt phthalocyanine. Nat Commun. 2019 Aug 9;10 (1) :3602.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light, stored under nitrogen)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Cobalt phthalocyanine
CAS Number3317-67-7
PubChem CID76829
IUPAC Namecobalt(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
Molecular FormulaC32H16CoN8
Molecular Weight571.5
Topological Polar Surface Area79.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count0
Heavy Atom Count41
Formal Charge0
Complexity709
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
InChIKey
MPMSMUBQXQALQI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cobalt phthalocyanine
CAS: 3317-67-7
CID: 76829
Formula: C32H16CoN8
MW: 571.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight571.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count0
Exact Mass571.082986
Monoisotopic Mass571.082986
Topological Polar Surface Area79.3 Ų
Heavy Atom Count41
Formal Charge0
Complexity709
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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