Chem
J-GLOBAL ID:200907048291981774   Nikkaji number:J2.302.849B

23,72,123,172-Tetrakis(2-methylpropoxy)phthalocyanine

23,72,123,172-テトラキス(2-メチルプロポキシ)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: C48H50N8O4
Molecular formula furigana: C48-H50-N8-O4
Molecular weight: 802.980
InChI: InChI=1S/C48H50N8O4/c1-25(2)21-57-29-9-13-33-37(17-29)45-51-41(33)49-42-35-15-11-31(59-23-27(5)6)19-39(35)47(53-42)56-48-40-20-32(60-24-28(7)8)12-16-36(40)44(54-48)50-43-34-14-10-30(58-22-26(3)4)18-38(34)46(52-43)55-45/h9-20,25-28H,21-24H2,1-8H3,(H2,49,50,51,52,53,54,55,56)
InChI key: FJZAEOPWDYRESU-UHFFFAOYSA-N
SMILES: CC(C)COc1ccc2/C/3=N/c4[nH]c(/N=C/5\N=C(/N=c/6\[nH]/c(=N\C(=N3)c2c1)/c1c6ccc(OCC(C)C)c1)c1c5cc(OCC(C)C)cc1)c1c4ccc(OCC(C)C)c1
Systematic name  (3):
  • 23,72,123,172-テトラキス(2-メチルプロポキシ)フタロシアニン
  • 6,16,24,34-テトラキス(2-メチルプロポキシ)-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
  • 6,16,24,34-tetrakis(2-methylpropoxy)-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):
  • 23,72,123,172-Tetrakis(2-methylpropoxy)phthalocyanine
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