F16CuPc

CAS Registry Number®

14916-87-1
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CAS Name

F16CuPc

Molecular Formula

C32CuF16N8

Cite this Page

F16CuPc.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=14916-87-1 (retrieved 2024-05-03) (CAS RN: 14916-87-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C32F16N8.Cu/c33-9-1-2(10(34)18(42)17(9)41)26-49-25(1)53-27-3-4(12(36)20(44)19(43)11(3)35)29(50-27)55-31-7-8(16(40)24(48)23(47)15(7)39)32(52-31)56-30-6-5(28(51-30)54-26)13(37)21(45)22(46)14(6)38;/q-2;+2

InChIKey

InChIKey=FJAOBQORBYMRNO-UHFFFAOYSA-N

SMILES

FC1=C2C=3[N-]4[Cu+2]56[N-]7C(=C8C(=C7N=C9[N]5=C(N=C4C2=C(F)C(F)=C1F)C=%10C9=C(F)C(F)=C(F)C%10F)C(F)=C(F)C(F)=C8F)N=C%11[N]6=C(N3)C=%12C%11=C(F)C(F)=C(F)C%12F

Canonical SMILES

FC1=C(F)C(F)=C2C(=C1F)C3=NC4=C5C(F)=C(F)C(F)=C(F)C5=C6N=C7C8=C(F)C(F)=C(F)C(F)=C8C=9N=C%10C=%11C(F)=C(F)C(F)=C(F)C%11C%12=NC2=[N]3[Cu+2]([N]79)([N-]46)[N-]%12%10

Other Names for this Substance

  • Copper, [1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-hexadecafluoro-29H,31H-phthalocyaninato(2-)-κN29,κN30,κN31,κN32]-, (SP-4-1)-
  • Copper, [hexadecafluorophthalocyaninato(2-)]-
  • Copper, [1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-hexadecafluoro-29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]-, (SP-4-1)-
  • 29H,31H-Phthalocyanine, 1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-hexadecafluoro-, copper complex
  • (SP-4-1)-[1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-Hexadecafluoro-29H,31H-phthalocyaninato(2-)-κN29,κN30,κN31,κN32]copper

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Deleted or Replaced CAS Registry Numbers

128653-33-8, 892546-20-2

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