chempirical

Zinc phthalocyanine

C32H16N8ZnCAS 14320-04-8577.92 g/mol

Open in Covalent MOL file
Zn2+NNN−NNN−NN

Properties

Molecular formula
C32H16N8Zn
Molar mass
577.92 g/mol
Exact mass
576.0789 Da
logP
6.03Crippen estimate
Polar surface area
105.5 Ų
H-bond donors / acceptors
0 / 6
Rotatable bonds
0

Identifiers

CAS number
14320-04-8
SMILES
[Zn+2].c1ccc2c(c1)-c1nc-2nc2[n-]c(nc3nc([n-]c4nc(n1)-c1ccccc1-4)-c1ccccc1-3)c1ccccc21
InChIKey
PODBBOVVOGJETB-UHFFFAOYSA-N
InChI
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

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

14 names · show all
  • Zinc, [29H,31H-phthalocyaninato(2-)-κN29,κN30,κN31,κN32]-, (SP-4-1)-
  • Zinc, [phthalocyaninato(2-)]-
  • Zinc, [29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]-, (SP-4-1)-
  • Phthalocyanine, zinc deriv.
  • 29H,31H-Phthalocyanine, zinc complex
  • 29H,31H-Phthalocyanine, zinc deriv.
  • (SP-4-1)-[29H,31H-Phthalocyaninato(2-)-κN29,κN30,κN31,κN32]zinc
  • Zinc phthalocyanine complex
  • Phthalocyaninatozinc
  • Zinc(II) phthalocyanine
  • CGP 55847
  • Ciaftalan zinc
  • Zinc(2+) phthalocyaninate
  • Fastogen blue 8510

Work with Zinc phthalocyanine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Iron(II) phthalocyanine132-16-184 % similar BM 64147-14-884 % similar Cobalt phthalocyanine3317-67-784 % similar Aluminum phthalocyanine chloride14154-42-877 % similar Titanyl phthalocyanine26201-32-177 % similar C.I. Direct blue 861330-38-742 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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