phthalocyanine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 101
Total Number of Articles : 145
PubChem 86280045
Molecular Formula

C32H18N8

SMILES

C1=CC=C2C(=C1)C3=NC4=NC(=NC5=C6C=CC=CC6=C(N5)N=C7C8=CC=CC=C8C(=N7)N=C2N3)C9=CC=CC=C94

InChI

InChI=1S/C32H18N8/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,(H2,33,34,35,36,37,38,39,40)

synonyms
  • PHTHALOCYANINE
  • 574-93-6
  • 29H,31H-Phthalocyanine
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Properties
Property Value
MW 514.5 g/mol
HBD 2
HBA 6
Rotatable Bond Count 0
Exact Mass 514.16544261 g/mol
Monoisotopic Mass 514.16544261 g/mol
Heavy Atom Count 40
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 777
xlogp 6.4
Topological Polar Surface Area 109