Chem
J-GLOBAL ID：200907091235144480   Nikkaji number：J841.517J

Tetra(3,5-di-tert-butylphenyl)porphyrin

テトラ(3,5-ジ-tert-ブチルフェニル)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： C76H94N4
Molecular formula furigana： C76-H94-N4
Molecular weight： 1063.616
InChI： InChI=1S/C76H94N4/c1-69(2,3)49-33-45(34-50(41-49)70(4,5)6)65-57-25-27-59(77-57)66(46-35-51(71(7,8)9)42-52(36-46)72(10,11)12)61-29-31-63(79-61)68(48-39-55(75(19,20)21)44-56(40-48)76(22,23)24)64-32-30-62(80-64)67(60-28-26-58(65)78-60)47-37-53(73(13,14)15)43-54(38-47)74(16,17)18/h25-44,77,80H,1-24H3/b65-57-,65-58-,66-59-,66-61-,67-60-,67-62-,68-63-,68-64-
InChI key： QDJDXOLMFCSORQ-ZOUHOBQGSA-N
SMILES： CC(C)(C)c1cc(cc(c1)C(C)(C)C)/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=C\5/C=CC1=N5)/c1cc(cc(c1)C(C)(C)C)C(C)(C)C)[nH]4)/c1cc(cc(c1)C(C)(C)C)C(C)(C)C)/C=C3)\c1cc(cc(c1)C(C)(C)C)C(C)(C)C)/[nH]2
Systematic name  (10)：
  • 5,10,15,20-テトラキス(3,5-ジ-tert-ブチルフェニル)-21H,23H-ポルフィリン
  • 5,10,15,20-テトラ(3,5-ジ-tert-ブチルフェニル)-21H,23H-ポルフィリン
  • 5,10,15,20-テトラキス[3,5-ジ(tert-ブチル)フェニル]-21H,23H-ポルフィリン
  • 5,10,15,20-テトラキス(3,5-ビス-tert-ブチルフェニル)-21H,23H-ポルフィリン
  • 5,10,15,20-テトラキス[3,5-ビス(tert-ブチル)フェニル]-21H,23H-ポルフィリン
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Other name (12)：
  • 5,10,15,20-Tetra(3,5-di-tert-butylphenyl)-21H,23H-porphyrin
  • テトラキス(3,5-ジ-tert-ブチルフェニル)ポルフィリン
  • 5,10,15,20-Tetrakis[3,5-di(tert-butyl)phenyl]-21H,23H-porphyrin
  • 5,10,15,20-Tetrakis(3,5-bis-tert-butylphenyl)-21H,23H-porphyrin
  • 5,10,15,20-Tetrakis[3,5-bis(tert-butyl)phenyl]-21H,23H-porphyrin
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Thsaurus map：
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