Chem
J-GLOBAL ID：200907098408200407   Nikkaji number：J1.484.386H

5,15-Bis(3,5-ditert-butylphenyl)-10,20-dibromo-21H,23H-porphyrin

5,15-ビス(3,5-ジtert-ブチルフェニル)-10,20-ジブロモ-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： C48H52Br2N4
Molecular formula furigana： C48-H52-BR2-N4
Molecular weight： 844.780
InChI： InChI=1S/C48H52Br2N4/c1-45(2,3)29-21-27(22-30(25-29)46(4,5)6)41-33-13-17-37(51-33)43(49)39-19-15-35(53-39)42(28-23-31(47(7,8)9)26-32(24-28)48(10,11)12)36-16-20-40(54-36)44(50)38-18-14-34(41)52-38/h13-26,51,54H,1-12H3/b41-33-,41-34-,42-35-,42-36-,43-37+,43-39+,44-38+,44-40+
InChI key： DMWADUYUJOECNM-DZOIGKAZSA-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)/Br)[nH]4)/c1cc(cc(c1)C(C)(C)C)C(C)(C)C)/C=C3)\Br)/[nH]2
Systematic name  (2)：
  • 5,15-ビス(3,5-ジtert-ブチルフェニル)-10,20-ジブロモ-21H,23H-ポルフィリン
  • 5,15-ビス(3,5-ジ-tert-ブチルフェニル)-10,20-ジブロモ-21H,23H-ポルフィリン
Other name (2)：
  • 5,15-Bis(3,5-di-tert-butylphenyl)-10,20-dibromo-21H,23H-porphyrin
  • 5,15-Bis(3,5-ditert-butylphenyl)-10,20-dibromo-21H,23H-porphyrin
Thsaurus map：
Thesaurus Map

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