Chem
J-GLOBAL ID：200907018127270640   Nikkaji number：J1.040.161E

Octabutoxyphthalocyanine

オクタブトキシフタロシアニン
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： C64H82N8O8
Molecular formula furigana： C64-H82-N8-O8
Molecular weight： 1091.408
InChI： InChI=1S/C64H82N8O8/c1-9-17-25-73-49-33-41-42(34-50(49)74-26-18-10-2)58-65-57(41)69-59-43-35-51(75-27-19-11-3)52(76-28-20-12-4)36-44(43)61(66-59)71-63-47-39-55(79-31-23-15-7)56(80-32-24-16-8)40-48(47)64(68-63)72-62-46-38-54(78-30-22-14-6)53(77-29-21-13-5)37-45(46)60(67-62)70-58/h33-40H,9-32H2,1-8H3,(H2,65,66,67,68,69,70,71,72)
InChI key： UESUFFTUZKESNL-UHFFFAOYSA-N
SMILES： CCCCOc1cc2/C/3=N/c4[nH]c(/N=C/5\N=C(/N=c/6\[nH]/c(=N\C(=N3)c2cc1OCCCC)/c1c6cc(OCCCC)c(OCCCC)c1)c1c5cc(OCCCC)c(OCCCC)c1)c1c4cc(OCCCC)c(OCCCC)c1
Systematic name  (9)：
  • 22,23,72,73,122,123,172,173-オクタブトキシ-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
  • 22,23,72,73,122,123,172,173-オクタブトキシフタロシアニン
  • 22,23,72,73,122,123,172,173-オクタキスブトキシフタロシアニン
  • 5,10,15,20-テトラアザ-22,23,72,73,122,123,172,173-オクタブトキシ-21H,23H-テトラベンゾ[b,g,l,q]ポルフィリン
  • 22,23,72,73,122,123,172,173-オクタキスブトキシ-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
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Other name (9)：
  • 22,23,72,73,122,123,172,173-Octabutoxy-5,10,15,20-tetraaza-21H,23H-tetrabenzo[b,g,l,q]porphyrin
  • 22,23,72,73,122,123,172,173-Octabutoxyphthalocyanine
  • オクタブトキシフタロシアニン
  • Octabutoxyphthalocyanine
  • 22,23,72,73,122,123,172,173-Octakisbutoxyphthalocyanine
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