Chem
J-GLOBAL ID：200907019526562146   Nikkaji number：J456.243G

1-(Chloromethyl)-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane

1-クロロメチル-4-フルオロ-1,4-ジアゾニアビシクロ[2.2.2]オクタン
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： C7H14ClF[N+]2
Molecular formula furigana： C7-H14-CL-F-N2
Molecular weight： 180.650
InChI： InChI=1S/C7H14ClFN2/c8-7-10-1-4-11(9,5-2-10)6-3-10/h1-7H2/q+2
InChI key： ZQGDSZPGKPJABN-UHFFFAOYSA-N
SMILES： F[N+]12CC[N+](CCl)(CC1)CC2
Systematic name  (7)：
  • 1-フルオロ-4-(クロロメチル)-1,4-ジアゾニアビシクロ[2.2.2]オクタン
  • 1-クロロメチル-4-フルオロ-1,4-ジアゾニアビシクロ[2.2.2]オクタン
  • 1-(クロロメチル)-4-フルオロ-1,4-ジアゾニアビシクロ[2.2.2]オクタン
  • 1-フルオロ-4-(クロロメチル)-1,4-ジアザビシクロ[2.2.2]オクタン-1,4-ジイウム
  • 1-(クロロメチル)-4-フルオロ-1,4-ジアザビシクロ[2.2.2]オクタン-1,4-ジイウム
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Other name (4)：
  • 1-(Chloromethyl)-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane
  • 1-Fluoro-4-(chloromethyl)-1,4-diazabicyclo[2.2.2]octane-1,4-diium
  • 1-(Chloromethyl)-4-fluoro-1,4-diazabicyclo[2.2.2]octane-1,4-diium
  • 1-Fluoro-4-chloromethyl-1,4-diazabicyclo[2.2.2]octane-1,4-diium
CAS registry number： 140681-54-5
Thsaurus map：
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