Chem
J-GLOBAL ID：200907054850062440   Nikkaji number：J1.106.069B

5,10,15,20-Tetrakis[3,4-di(2-ethylhexyloxy)phenyl]-21H,23H-porphyrin

5,10,15,20-テトラキス[3,4-ジ(2-エチルヘキシルオキシ)フェニル]-21H,23H-ポルフィリン
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： C108H158N4O8
Molecular formula furigana： C108-H158-N4-O8
Molecular weight： 1640.472
InChI： InChI=1S/C108H158N4O8/c1-17-33-41-77(25-9)69-113-97-61-49-85(65-101(97)117-73-81(29-13)45-37-21-5)105-89-53-55-91(109-89)106(86-50-62-98(114-70-78(26-10)42-34-18-2)102(66-86)118-74-82(30-14)46-38-22-6)93-57-59-95(111-93)108(88-52-64-100(116-72-80(28-12)44-36-20-4)104(68-88)120-76-84(32-16)48-40-24-8)96-60-58-94(112-96)107(92-56-54-90(105)110-92)87-51-63-99(115-71-79(27-11)43-35-19-3)103(67-87)119-75-83(31-15)47-39-23-7/h49-68,77-84,109,112H,17-48,69-76H2,1-16H3/b105-89-,105-90-,106-91-,106-93-,107-92-,107-94-,108-95-,108-96-
InChI key： JMYCSSXIJRTVFY-NBYUKXDQSA-N
SMILES： CCCCC(CC)COc1ccc(cc1OCC(CC)CCCC)/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=C\5/C=CC1=N5)/c1ccc(OCC(CC)CCCC)c(OCC(CC)CCCC)c1)[nH]4)/c1ccc(OCC(CC)CCCC)c(OCC(CC)CCCC)c1)/C=C3)\c1ccc(OCC(CC)CCCC)c(OCC(CC)CCCC)c1)/[nH]2
Systematic name  (5)：
  • 5,10,15,20-テトラキス[3,4-ジ(2-エチルヘキシルオキシ)フェニル]-21H,23H-ポルフィリン
  • 5,10,15,20-テトラキス[3,4-ビス[(2-エチルヘキシル)オキシ]フェニル]-21H,23H-ポルフィリン
  • 5,10,15,20-テトラキス[3,4-ビス(2-エチルヘキシルオキシ)フェニル]-21H,23H-ポルフィリン
  • 2,7,12,17-テトラキス({3,4-ビス[(2-エチルヘキシル)オキシ]フェニル})-21,22,23,24-テトラアザペンタシクロ[16.2.1.13,6.18,11.113,16]テトラコサ-1,3,5,7,9,11(23),12,14,16,18(21),19-ウンデカエン
  • 2,7,12,17-tetrakis({3,4-bis[(2-ethylhexyl)oxy]phenyl})-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene
Other name (3)：
  • 5,10,15,20-Tetrakis[3,4-di(2-ethylhexyloxy)phenyl]-21H,23H-porphyrin
  • 5,10,15,20-Tetrakis[3,4-bis[(2-ethylhexyl)oxy]phenyl]-21H,23H-porphyrin
  • 5,10,15,20-Tetrakis[3,4-bis(2-ethylhexyloxy)phenyl]-21H,23H-porphyrin
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