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Substance Name: Cuprate(4-), (29H,31H-phthalocyanine-2,9,16,24-tetrasulfonato(6-)-kappaN29,kappaN30,kappaN31,kappaN32)-, sodium (1:4), (SP-4-2)-
RN: 68239-53-2
InChIKey: HMPXSWYLSSRSQF-UHFFFAOYSA-J

Molecular Formula

  • C32-H12-Cu-N8-O12-S4.4Na

Molecular Weight

  • 984.261
 
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Names and Synonyms

Synonym

  • EINECS 269-448-4

Systematic Names

  • Cuprate(4-), (29H,31H-phthalocyanine-2,9,16,24-tetrasulfonato(6-)-kappaN29,kappaN30,kappaN31,kappaN32)-, sodium (1:4), (SP-4-2)-
  • Cuprate(4-), (29H,31H-phthalocyanine-2,9,16,24-tetrasulfonato(6-)-kappaN29,kappaN30,kappaN31,kappaN32)-, tetrasodium, (SP-4-2)-
  • Cuprate(4-), (29H,31H-phthalocyanine-2,9,16,24-tetrasulfonato(6-)-N29,N39,N31,N32)-, tetrasodium, (SP-4-2)-
  • Tetrasodium (29H,31H-phthalocyanine-2,9,16,24-tetrasulphonato(6-)-N29,N30,N31,N32)cuprate(4-)

Registry Numbers

CAS Registry Number

  • 68239-53-2

System Generated Number

  • 0068239532

Molecular Formulas

Molecular Formula

  • C32-H12-Cu-N8-O12-S4.4Na

Molecular Formula Fragments

  • C32-H12-Cu-N8-O12-S4
  • COMPONENT
  • Na

Structure Descriptors

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

InChIKey

HMPXSWYLSSRSQF-UHFFFAOYSA-J

Smiles

[Na+].[Cu+2].S(=O)(c1ccc2c3[n-]c(c2c1)nc1nc(nc2c4ccc(cc4c(nc4c5ccc(cc5c(n4)n3)S(=O)(=O)[O-])[n-]2)S([O-])(=O)=O)c2cc(ccc12)S([O-])(=O)=O)(=O)[O-].[Na+].[Na+].[Na+]