Chem
J-GLOBAL ID：200907030310611243
Nikkaji number：J2.775.749I
10,20-Bis(4-ethynylphenyl)-21H,23H-porphyrin
10,20-ビス(4-エチニルフェニル)-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： C36H22N4
Molecular formula furigana： C36-H22-N4
Molecular weight： 510.600
InChI：
InChI=1S/C36H22N4/c1-3-23-5-9-25(10-6-23)35-31-17-13-27(37-31)21-29-15-19-33(39-29)36(26-11-7-24(4-2)8-12-26)34-20-16-30(40-34)22-28-14-18-32(35)38-28/h1-2,5-22,37,40H/b27-21-,28-22-,29-21-,30-22-,35-31-,35-32-,36-33-,36-34-
InChI key：
DSFNWSGQKVTRIP-WTFXTOSCSA-N
SMILES：
C#Cc1ccc(cc1)/C/1=c/2\cc/c(=C/C3=N/C(=C(\c4ccc(/C=C\5/C=CC1=N5)[nH]4)/c1ccc(cc1)C#C)/C=C3)/[nH]2
Systematic name (1)：
- 10,20-ビス(4-エチニルフェニル)-21H,23H-ポルフィリン
- 10,20-Bis(4-ethynylphenyl)-21H,23H-porphyrin
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