Chem
J-GLOBAL ID：200907098069952615
Nikkaji number：J2.076.224A
1,1′-[(1,4-Phenylene)bisethynylenebis(4,1-phenylene)]bis[1,3,5-triazine-2,4,6(1H,3H,5H)-trione]
1,1′-[(1,4-フェニレン)ビスエチニレンビス(4,1-フェニレン)]ビス[1,3,5-トリアジン-2,4,6(1H,3H,5H)-トリオン]
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： C28H16N6O6
Molecular formula furigana： C28-H16-N6-O6
Molecular weight： 532.472
InChI：
InChI=1S/C28H16N6O6/c35-23-29-25(37)33(26(38)30-23)21-13-9-19(10-14-21)7-5-17-1-2-18(4-3-17)6-8-20-11-15-22(16-12-20)34-27(39)31-24(36)32-28(34)40/h1-4,9-16H,(H2,29,30,35,37,38)(H2,31,32,36,39,40)
InChI key：
TUYVWJUMSPPQOQ-UHFFFAOYSA-N
SMILES：
O=c1[nH]c(=O)n(c2ccc(cc2)C#Cc2ccc(cc2)C#Cc2ccc(cc2)n2c(=O)[nH]c(=O)[nH]c2=O)c(=O)[nH]1
Systematic name (3)：
- 1,1′-[(1,4-フェニレン)ビスエチニレンビス(4,1-フェニレン)]ビス[1,3,5-トリアジン-2,4,6(1H,3H,5H)-トリオン]
- 1-{4-[2-(4-{2-[4-(2,4,6-トリオキソ-1,3,5-トリアジナン-1-イル)フェニル]エチニル}フェニル)エチニル]フェニル}-1,3,5-トリアジナン-2,4,6-トリオン
- 1-{4-[2-(4-{2-[4-(2,4,6-trioxo-1,3,5-triazinan-1-yl)phenyl]ethynyl}phenyl)ethynyl]phenyl}-1,3,5-triazinane-2,4,6-trione
- 1,1′-[(1,4-Phenylene)bisethynylenebis(4,1-phenylene)]bis[1,3,5-triazine-2,4,6(1H,3H,5H)-trione]
Return to Previous Page
