Chem
J-GLOBAL ID:200907002790400197   Nikkaji number:J1.436.362I

3,6-Dibutoxy-4-bromophthalonitrile

3,6-ジブトキシ-4-ブロモフタロニトリル
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: C16H19BrN2O2
Molecular formula furigana: C16-H19-BR-N2-O2
Molecular weight: 351.244
InChI: InChI=1S/C16H19BrN2O2/c1-3-5-7-20-15-9-14(17)16(21-8-6-4-2)13(11-19)12(15)10-18/h9H,3-8H2,1-2H3
InChI key: AYGKNJJGSMKDPA-UHFFFAOYSA-N
SMILES: CCCCOc1cc(Br)c(OCCCC)c(C#N)c1C#N
Systematic name  (3):
  • 3,6-ジブトキシ-4-ブロモフタロニトリル
  • 4-ブロモ-3,6-ジブトキシベンゼン-1,2-ジカルボニトリル
  • 4-bromo-3,6-dibutoxybenzene-1,2-dicarbonitrile
Other name (1):
  • 3,6-Dibutoxy-4-bromophthalonitrile
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