Chem
J-GLOBAL ID：200907093499439111   Nikkaji number：J1.720.513G

1,4,8,11,15,18,22,25-Octaphenylphthalocyanine

1,4,8,11,15,18,22,25-オクタフェニルフタロシアニン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C80H50N8
Molecular formula furigana： C80-H50-N8
Molecular weight： 1123.336
InChI： InChI=1S/C80H50N8/c1-9-25-49(26-10-1)57-41-42-58(50-27-11-2-12-28-50)66-65(57)73-81-74(66)86-76-69-61(53-33-17-5-18-34-53)45-46-62(54-35-19-6-20-36-54)70(69)78(83-76)88-80-72-64(56-39-23-8-24-40-56)48-47-63(55-37-21-7-22-38-55)71(72)79(84-80)87-77-68-60(52-31-15-4-16-32-52)44-43-59(51-29-13-3-14-30-51)67(68)75(82-77)85-73/h1-48H,(H2,81,82,83,84,85,86,87,88)
InChI key： ZIWOPSSITPUART-UHFFFAOYSA-N
SMILES： c1ccc(cc1)c1ccc(c2ccccc2)c2/C/3=N/c4[nH]c(/N=C/5\N=C(/N=c/6\[nH]/c(=N\C(=N3)c12)/c1c6c(ccc1c1ccccc1)c1ccccc1)c1c5c(ccc1c1ccccc1)c1ccccc1)c1c4c(ccc1c1ccccc1)c1ccccc1
Systematic name  (5)：
  • 21,24,71,74,121,124,171,174-オクタフェニルフタロシアニン
  • 21,24,121,124,71,74,171,174-オクタフェニルフタロシアニン
  • 21,24,71,74,121,124,171,174-オクタフェニル-5,10,15,20-テトラアザ-21H,23H-テトラベンゾ[b,g,l,q]ポルフィリン
  • 5,8,14,17,23,26,32,35-オクタフェニル-2,11,20,29,37,38,39,40-オクタアザノナシクロ[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]テトラコンタ-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-ノナデカエン
  • 5,8,14,17,23,26,32,35-octaphenyl-2,11,20,29,37,38,39,40-octaazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene
Other name (5)：
  • 21,24,71,74,121,124,171,174-Octaphenylphthalocyanine
  • 1,4,8,11,15,18,22,25-オクタフェニルフタロシアニン
  • 1,4,8,11,15,18,22,25-Octaphenylphthalocyanine
  • 21,24,121,124,71,74,171,174-Octaphenylphthalocyanine
  • 21,24,71,74,121,124,171,174-Octaphenyl-5,10,15,20-tetraaza-21H,23H-tetrabenzo[b,g,l,q]porphyrin
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