Chem
J-GLOBAL ID:200907025874312404   Nikkaji number:J2.261.761C

1,1′-(3-Hydroxypropylidene)bis(4-butyl-1H-1,2,4-triazole-4-ium)

1,1′-(3-ヒドロキシプロピリデン)ビス(4-ブチル-1H-1,2,4-トリアゾール-4-イウム)
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: C15H28N4[N+]2O
Molecular formula furigana: C15-H28-N6-O
Molecular weight: 308.429
InChI: InChI=1S/C15H28N6O/c1-3-5-8-18-11-16-20(13-18)15(7-10-22)21-14-19(12-17-21)9-6-4-2/h11-15,22H,3-10H2,1-2H3/q+2
InChI key: BJCODSIHTBYMQM-UHFFFAOYSA-N
SMILES: CCCC[n+]1cnn(c1)C(CCO)n1c[n+](CCCC)cn1
Systematic name  (3):
  • 1,1′-(3-ヒドロキシプロピリデン)ビス(4-ブチル-1H-1,2,4-トリアゾール-4-イウム)
  • 4-ブチル-1-[1-(4-ブチル-1H-1,2,4-トリアゾール-4-イウム-1-イル)-3-ヒドロキシプロピル]-1H-1,2,4-トリアゾール-4-イウム
  • 4-butyl-1-[1-(4-butyl-1H-1,2,4-triazol-4-ium-1-yl)-3-hydroxypropyl]-1H-1,2,4-triazol-4-ium
Other name (1):
  • 1,1′-(3-Hydroxypropylidene)bis(4-butyl-1H-1,2,4-triazole-4-ium)
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