Chem
J-GLOBAL ID：200907001192090845   Nikkaji number：J1.991.716I

21,71,121,171-Tetrakis(2,4-di-tert-butylphenoxy)phthalocyanine

21,71,121,171-テトラキス(2,4-ジ-tert-ブチルフェノキシ)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： C88H98N8O4
Molecular formula furigana： C88-H98-N8-O4
Molecular weight： 1331.804
InChI： InChI=1S/C88H98N8O4/c1-81(2,3)49-37-41-61(57(45-49)85(13,14)15)97-65-33-25-29-53-69(65)77-89-73(53)94-78-71-55(31-27-35-67(71)99-63-43-39-51(83(7,8)9)47-59(63)87(19,20)21)75(91-78)96-80-72-56(32-28-36-68(72)100-64-44-40-52(84(10,11)12)48-60(64)88(22,23)24)76(92-80)95-79-70-54(74(90-79)93-77)30-26-34-66(70)98-62-42-38-50(82(4,5)6)46-58(62)86(16,17)18/h25-48H,1-24H3,(H2,89,90,91,92,93,94,95,96)
InChI key： LKRIPJZZXGEOFO-UHFFFAOYSA-N
SMILES： CC(C)(C)c1ccc(Oc2cccc3/C/4=N/c5[nH]c(/N=C/6\N=C(/N=c/7\[nH]/c(=N\C(=N4)c23)/c2c7c(Oc3ccc(cc3C(C)(C)C)C(C)(C)C)ccc2)c2c6c(Oc3ccc(cc3C(C)(C)C)C(C)(C)C)ccc2)c2c5c(Oc3ccc(cc3C(C)(C)C)C(C)(C)C)ccc2)c(c1)C(C)(C)C
Systematic name  (4)：
  • 21,71,121,171-テトラキス(2,4-ジ-tert-ブチルフェノキシ)フタロシアニン
  • 24,74,124,174-テトラキス(2,4-ジ-tert-ブチルフェノキシ)フタロシアニン
  • 5,14,23,32-テトラキス(2,4-ジ-tert-ブチルフェノキシ)-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
  • 5,14,23,32-tetrakis(2,4-di-tert-butylphenoxy)-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 (2)：
  • 24,74,124,174-Tetrakis(2,4-di-tert-butylphenoxy)phthalocyanine
  • 21,71,121,171-Tetrakis(2,4-di-tert-butylphenoxy)phthalocyanine
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM