Chem
J-GLOBAL ID：200907063041825350   Nikkaji number：J276.809G

1,2,3-Tris(3,8-dimethyl-5-isopropyl-1-azulenyl)cyclopropenylium

1,2,3-トリス(3,8-ジメチル-5-イソプロピル-1-アズレニル)シクロプロペニリウム
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： C48H51
Molecular formula furigana： C48-H51
Molecular weight： 627.936
InChI： InChI=1S/C48H54/c1-25(2)34-16-13-28(7)43-37(22-34)31(10)19-40(43)46-47(41-20-32(11)38-23-35(26(3)4)17-14-29(8)44(38)41)48(46)42-21-33(12)39-24-36(27(5)6)18-15-30(9)45(39)42/h13-27,46-48H,1-12H3
InChI key： AJDJKCHWCZLLNE-UHFFFAOYSA-N
SMILES： CC(C)c1ccc(C)c2c(cc(C)c2c1)C1C(C1c1cc(C)c2cc(ccc(C)c12)C(C)C)c1cc(C)c2cc(ccc(C)c12)C(C)C
Systematic name  (3)：
  • 1,2,3-トリス(3,8-ジメチル-5-イソプロピルアズレン-1-イル)シクロプロペニリウム
  • 1,2,3-トリス(5-イソプロピル-3,8-ジメチルアズレン-1-イル)シクロプロペニリウム
  • 1,2,3-トリス(3,8-ジメチル-5-イソプロピル-1-アズレニル)シクロプロペニリウム
Other name (2)：
  • 1,2,3-Tris(5-isopropyl-3,8-dimethylazulen-1-yl)cyclopropenylium
  • 1,2,3-Tris(3,8-dimethyl-5-isopropyl-1-azulenyl)cyclopropenylium
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