Chem
J-GLOBAL ID：200907065513270725   Nikkaji number：J1.083.116D

Phenylbis(3,6-di-tert-butyl-1-azulenyl)methyl cation

フェニルビス(3,6-ジ-tert-ブチル-1-アズレニル)メチルカチオン
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： C42[C+]H51
Molecular formula furigana： C43-H51
Molecular weight： 567.880
InChI： InChI=1S/C43H51/c1-40(2,3)29-18-22-31-33(24-20-29)37(42(7,8)9)26-35(31)39(28-16-14-13-15-17-28)36-27-38(43(10,11)12)34-25-21-30(41(4,5)6)19-23-32(34)36/h13-27H,1-12H3/q+1
InChI key： BOMBYFVFRDBTDT-UHFFFAOYSA-N
SMILES： CC(C)(C)c1cc([C+](c2cc(c3ccc(ccc23)C(C)(C)C)C(C)(C)C)c2ccccc2)c2ccc(ccc12)C(C)(C)C
Systematic name  (4)：
  • ビス(3,6-ジ-tert-ブチル-1-アズレニル)(フェニル)メチルカチオン
  • フェニルビス(3,6-ジ-tert-ブチル-1-アズレニル)メチルカチオン
  • ビス(3,6-ジ-tert-ブチルアズレン-1-イル)(フェニル)メチリウム
  • bis(3,6-di-tert-butylazulen-1-yl)(phenyl)methylium
Other name (2)：
  • Phenylbis(3,6-di-tert-butyl-1-azulenyl)methyl cation
  • Bis(3,6-di-tert-butyl-1-azulenyl)(phenyl)methyl cation
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