Chem
J-GLOBAL ID：200907014179193923
Nikkaji number：J1.943.352H
10,10′-(1,3-Phenylene)bis(5,15-diphenyl-21H,23H-porphyrin)
10,10′-(1,3-フェニレン)ビス(5,15-ジフェニル-21H,23H-ポルフィリン)
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
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
Molecular formula： C70H46N8
Molecular formula furigana： C70-H46-N8
Molecular weight： 999.194
InChI：
InChI=1S/C70H46N8/c1-5-14-43(15-6-1)65-53-28-24-49(71-53)41-50-25-29-54(72-50)66(44-16-7-2-8-17-44)58-33-37-62(76-58)69(61-36-32-57(65)75-61)47-22-13-23-48(40-47)70-63-38-34-59(77-63)67(45-18-9-3-10-19-45)55-30-26-51(73-55)42-52-27-31-56(74-52)68(46-20-11-4-12-21-46)60-35-39-64(70)78-60/h1-42,71,73,76,78H/b49-41-,50-41-,51-42-,52-42-,65-53-,65-57-,66-54-,66-58-,67-55-,67-59-,68-56-,68-60-,69-61-,69-62-,70-63-,70-64-
InChI key：
UITSTRLBEVTKMN-YEMDXINXSA-N
SMILES：
C1=CC2=N/C/1=C\c1ccc([nH]1)/C(=C\1/C=CC(=N1)/C(=c\1/cc/c(=C/2\c2ccccc2)/[nH]1)/c1cccc(c1)/C/1=c/2\cc/c(=C(/C3=N/C(=C\c4ccc(/C(=C\5/C=CC1=N5)/c1ccccc1)[nH]4)/C=C3)\c1ccccc1)/[nH]2)/c1ccccc1
Systematic name (1)：
- 10,10′-(1,3-フェニレン)ビス(5,15-ジフェニル-21H,23H-ポルフィリン)
- 10,10′-(1,3-Phenylene)bis(5,15-diphenyl-21H,23H-porphyrin)
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