Chem
J-GLOBAL ID：200907095801696504   Nikkaji number：J634.961G

4,4′-p-Xylylenebis(1,4,7,10-tetraazacyclotridecane)

4,4′-p-キシリレンビス(1,4,7,10-テトラアザシクロトリデカン)
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： C26H50N8
Molecular formula furigana： C26-H50-N8
Molecular weight： 474.742
InChI： InChI=1S/C26H50N8/c1-7-27-11-13-31-17-21-33(19-15-29-9-1)23-25-3-5-26(6-4-25)24-34-20-16-30-10-2-8-28-12-14-32-18-22-34/h3-6,27-32H,1-2,7-24H2
InChI key： WCBHWWCRMPMBTH-UHFFFAOYSA-N
SMILES： C(N1CCNCCCNCCNCC1)c1ccc(CN2CCNCCCNCCNCC2)cc1
Systematic name  (4)：
  • 1,1′-(1,4-フェニレンビスメチレン)ビス(1,4,7,11-テトラアザシクロトリデカン)
  • 4,4′-p-キシリレンビス(1,4,7,10-テトラアザシクロトリデカン)
  • 4-({4-[(1,4,7,10-テトラアザシクロトリデカン-4-イル)メチル]フェニル}メチル)-1,4,7,10-テトラアザシクロトリデカン
  • 4-({4-[(1,4,7,10-tetraazacyclotridecan-4-yl)methyl]phenyl}methyl)-1,4,7,10-tetraazacyclotridecane
Other name (2)：
  • 1,1′-(1,4-Phenylenebismethylene)bis(1,4,7,11-tetraazacyclotridecane)
  • 4,4′-p-Xylylenebis(1,4,7,10-tetraazacyclotridecane)
Thsaurus map：
Thesaurus Map

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