Chem
J-GLOBAL ID：200907006543672643   Nikkaji number：J2.118.153F

5,15-Bis(3,5-di-tert-butylphenyl)-10,20-bis(2,6-dibromophenyl)-21H,23H-porphyrin

5,15-ビス(3,5-ジ-tert-ブチルフェニル)-10,20-ビス(2,6-ジブロモフェニル)-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： C60H58Br4N4
Molecular formula furigana： C60-H58-BR4-N4
Molecular weight： 1154.768
InChI： InChI=1S/C60H58Br4N4/c1-57(2,3)35-27-33(28-36(31-35)58(4,5)6)51-43-19-23-47(65-43)55(53-39(61)15-13-16-40(53)62)49-25-21-45(67-49)52(34-29-37(59(7,8)9)32-38(30-34)60(10,11)12)46-22-26-50(68-46)56(48-24-20-44(51)66-48)54-41(63)17-14-18-42(54)64/h13-32,65,68H,1-12H3/b51-43-,51-44-,52-45-,52-46-,55-47+,55-49+,56-48+,56-50+
InChI key： CWAHZTBAECSEOC-PASQTYJSSA-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)/c1c(Br)cccc1Br)[nH]4)/c1cc(cc(c1)C(C)(C)C)C(C)(C)C)/C=C3)\c1c(Br)cccc1Br)/[nH]2
Systematic name  (1)：
  • 5,15-ビス(3,5-ジ-tert-ブチルフェニル)-10,20-ビス(2,6-ジブロモフェニル)-21H,23H-ポルフィリン
Other name (1)：
  • 5,15-Bis(3,5-di-tert-butylphenyl)-10,20-bis(2,6-dibromophenyl)-21H,23H-porphyrin
Thsaurus map：
Thesaurus Map

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