Chem
J-GLOBAL ID：200907092333478384   Nikkaji number：J2.491.471B

4-(1,3-Dithian-2-yl)benzonitrile

4-(1,3-ジチアン-2-イル)ベンゾニトリル
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： C11H11NS2
Molecular formula furigana： C11-H11-N-S2
Molecular weight： 221.340
InChI： InChI=1S/C11H11NS2/c12-8-9-2-4-10(5-3-9)11-13-6-1-7-14-11/h2-5,11H,1,6-7H2
InChI key： HJKDEHIETWUANJ-UHFFFAOYSA-N
SMILES： N#Cc1ccc(cc1)C1SCCCS1
Systematic name  (4)：
  • 4-(1,3-ジチアン-2-イル)ベンゾニトリル
  • 4-シアノベンズアルデヒドトリメチレンジチオアセタール
  • p-(1,3-ジチアン-2-イル)ベンゾニトリル
  • 4-(1,3-dithian-2-yl)benzonitrile
Other name (4)：
  • 4-(1,3-Dithiane-2-yl)benzonitrile
  • 4-Cyanobenzaldehyde trimethylene dithioacetal
  • 4-(1,3-Dithian-2-yl)benzonitrile
  • p-(1,3-Dithiane-2-yl)benzonitrile
CAS registry number： 50603-38-8
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