Chem
J-GLOBAL ID:201707017558456690   Nikkaji number:J3.591.444G

1,1′-(Pyrene-2,7-diyl)bis(2-iodo-ethynyl-4-(tert-butyl)benzene)

2,7-ビス[4-tert-ブチル-2-(2-ヨードエチニル)フェニル]ピレン
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: C40H32I2
Molecular formula furigana: C40-H32-I2
Molecular weight: 766.505
InChI: InChI=1S/C40H32I2/c1-39(2,3)33-11-13-35(25(23-33)15-17-41)31-19-27-7-9-29-21-32(22-30-10-8-28(20-31)37(27)38(29)30)36-14-12-34(40(4,5)6)24-26(36)16-18-42/h7-14,19-24H,1-6H3
InChI key: ZNWSJKJUKGWNNU-UHFFFAOYSA-N
SMILES: CC(C)(C)c1ccc(c2cc3ccc4cc(cc5ccc(c2)c3c45)c2ccc(cc2C#CI)C(C)(C)C)c(c1)C#CI
Systematic name  (3):
  • 1,1′-(ピレン-2,7-ジイル)ビス(2-ヨード-エチニル-4-(tert-ブチル)ベンゼン)
  • 2,7-ビス[4-tert-ブチル-2-(2-ヨードエチニル)フェニル]ピレン
  • 2,7-bis[4-tert-butyl-2-(2-iodoethynyl)phenyl]pyrene
Other name (1):
  • 1,1′-(Pyrene-2,7-diyl)bis(2-iodo-ethynyl-4-(tert-butyl)benzene)
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