Chem
J-GLOBAL ID：200907012939878554   Nikkaji number：J1.435.570G

24,74,124,174-Tetrakis(4-methylphenyl)phthalocyanine

24,74,124,174-テトラキス(4-メチルフェニル)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： C60H42N8
Molecular formula furigana： C60-H42-N8
Molecular weight： 875.052
InChI： InChI=1S/C60H42N8/c1-33-17-25-37(26-18-33)41-9-5-13-45-49(41)57-61-53(45)66-58-51-43(39-29-21-35(3)22-30-39)11-7-15-47(51)55(63-58)68-60-52-44(40-31-23-36(4)24-32-40)12-8-16-48(52)56(64-60)67-59-50-42(38-27-19-34(2)20-28-38)10-6-14-46(50)54(62-59)65-57/h5-32H,1-4H3,(H2,61,62,63,64,65,66,67,68)
InChI key： UNNKUNZOKDHBRG-UHFFFAOYSA-N
SMILES： Cc1ccc(cc1)c1cccc2/C/3=N/c4[nH]c(/N=C/5\N=C(/N=c/6\[nH]/c(=N\C(=N3)c12)/c1c6c(ccc1)c1ccc(C)cc1)c1c5c(ccc1)c1ccc(C)cc1)c1c4c(ccc1)c1ccc(C)cc1
Systematic name  (3)：
  • 24,74,124,174-テトラキス(4-メチルフェニル)フタロシアニン
  • 5,14,23,32-テトラキス(4-メチルフェニル)-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
  • 5,14,23,32-tetrakis(4-methylphenyl)-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 (1)：
  • 24,74,124,174-Tetrakis(4-methylphenyl)phthalocyanine
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