Chem
J-GLOBAL ID:201507013955422450   Nikkaji number:J3.436.954B

1,2:6,7-Di(2-iodovinylene(5-(tert-butyl)-1,2-phenylene))pyrene

1,2:6,7-ジ(2-ヨードビニレン(5-(tert-ブチル)-1,2-フェニレン))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)23-9-13-25-29-15-21-7-12-28-32-20-36(42)34-18-24(40(4,5)6)10-14-26(34)30(32)16-22-8-11-27(37(21)38(22)28)31(29)19-35(41)33(25)17-23/h7-20H,1-6H3
InChI key: RYPMDBJDISHFKS-UHFFFAOYSA-N
SMILES: CC(C)(C)c1ccc2c(c1)c(I)cc1c3ccc4cc5c6ccc(cc6c(I)cc5c5ccc(cc21)c3c45)C(C)(C)C
Systematic name  (4):
  • 7,7′-ジ-tert-ブチル-9,9′-ジヨード-1,3′:1′,3-ビスエテノ-2,2′-ビフェナントレン
  • 1,2:6,7-ジ(2-ヨードビニレン(5-(tert-ブチル)-1,2-フェニレン))ピレン
  • 7,22-ジ-tert-ブチル-4,19-ジヨードオクタシクロ[14.14.2.02,11.05,10.013,31.017,26.020,25.028,32]ドトリアコンタ-1,3,5,7,9,11,13,15,17(26),18,20,22,24,27,29,31-ヘキサデカエン
  • 7,22-di-tert-butyl-4,19-diiodooctacyclo[14.14.2.02,11.05,10.013,31.017,26.020,25.028,32]dotriaconta-1,3,5,7,9,11,13,15,17(26),18,20,22,24,27,29,31-hexadecaene
Other name (2):
  • 7,7′-Di-tert-butyl-9,9′-diiodo-1,3′:1′,3-bisetheno-2,2′-biphenanthrene
  • 1,2:6,7-Di(2-iodovinylene(5-(tert-butyl)-1,2-phenylene))pyrene
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