Analyte Name

Tetrahydrogen 4,4',4'',4'''-phthalocyaninetetrasulfonato(2-)-Copper, tetrasodium salt

CAS Number

14285-63-3

Molecular Formula

C32H12CuN8O12S4.4Na

Molecular Weight

984.25

Accurate Mass

982.83

SMILES

Na+].O=S(=O)([O-])C1=CC=C2C(=C1)C3=NC4=C5C=CC(=CC5=C6N=C7C8=CC=C(C=C8C=9N=C%10C=%11C=CC(=CC%11C%12=NC2=[N]3[Cu+2]([N]79)([N-]46)[N-]%10%12)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]

InChI

InChI=1S/C32H16N8O12S4.Cu.4Na/c41-53(42,43)13-1-5-17-21(9-13)29-33-25(17)37-30-22-10-14(54(44,45)46)2-6-18(22)27(34-30)39-32-24-12-16(56(50,51)52)4-8-20(24)28(36-32)40-31-23-11-15(55(47,48)49)3-7-19(23)26(35-31)38-29;;;;;/h1-12H,(H4-2,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52);;;;;/q-2;+2;4*+1/p-4

IUPAC

Sodium (SP-4-1)-[29H,31H-phthalocyanine-2,9,16,23-tetrasulfonato(6-)-?N29,?N30,?N31,?N32]cuprate(4-) (4:1)

Alternate CAS Number

93745-93-8

Country of Origin

CANADA

Product Format

Neat