Chem
J-GLOBAL ID：200907012960460403   Nikkaji number：J1.634.088J

5,10-Bis(4-tert-butylphenyl)-21H,23H-porphyrin

5,10-ビス(4-tert-ブチルフェニル)-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： C40H38N4
Molecular formula furigana： C40-H38-N4
Molecular weight： 574.772
InChI： InChI=1S/C40H38N4/c1-39(2,3)27-11-7-25(8-12-27)37-33-19-17-31(42-33)23-29-15-16-30(41-29)24-32-18-20-34(43-32)38(36-22-21-35(37)44-36)26-9-13-28(14-10-26)40(4,5)6/h7-24,42-43H,1-6H3/b29-23-,30-24-,31-23-,32-24-,37-33-,37-35-,38-34-,38-36-
InChI key： LMRVNYXIMFAHHP-ZMRYZNJVSA-N
SMILES： CC(C)(C)c1ccc(cc1)/C/1=c/2\cc/c(=C/C3=N/C(=C\c4ccc(/C(=C\5/C=CC1=N5)/c1ccc(cc1)C(C)(C)C)[nH]4)/C=C3)/[nH]2
Systematic name  (3)：
  • 5,10-ビス(4-tert-ブチルフェニル)-21H,23H-ポルフィリン
  • 2,17-ビス(4-tert-ブチルフェニル)-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
  • 2,17-bis(4-tert-butylphenyl)-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 (1)：
  • 5,10-Bis(4-tert-butylphenyl)-21H,23H-porphyrin
Thsaurus map：
Thesaurus Map

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