Chem
J-GLOBAL ID:200907055588492280   Nikkaji number:J2.592.457F

1,4-Diiodo-2,3,5,6-tetrakis[4-(3,7-dimethyloctyl)phenyl]benzene

1,4-ジヨード-2,3,5,6-テトラキス[4-(3,7-ジメチルオクチル)フェニル]ベンゼン
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: C70H100I2
Molecular formula furigana: C70-H100-I2
Molecular weight: 1195.379
InChI: InChI=1S/C70H100I2/c1-49(2)17-13-21-53(9)25-29-57-33-41-61(42-34-57)65-66(62-43-35-58(36-44-62)30-26-54(10)22-14-18-50(3)4)70(72)68(64-47-39-60(40-48-64)32-28-56(12)24-16-20-52(7)8)67(69(65)71)63-45-37-59(38-46-63)31-27-55(11)23-15-19-51(5)6/h33-56H,13-32H2,1-12H3
InChI key: PTZNBGVUDHFVRF-UHFFFAOYSA-N
SMILES: CC(C)CCCC(C)CCc1ccc(cc1)c1c(I)c(c2ccc(CCC(C)CCCC(C)C)cc2)c(c(I)c1c1ccc(CCC(C)CCCC(C)C)cc1)c1ccc(CCC(C)CCCC(C)C)cc1
Systematic name  (3):
  • 1,4-ジヨード-2,3,5,6-テトラキス[4-(3,7-ジメチルオクチル)フェニル]ベンゼン
  • 4'-(3,7-ジメチルオクチル)-2,4,5-トリス[4-(3,7-ジメチルオクチル)フェニル]-3,6-ジヨード-1,1'-ビフェニル
  • 4'-(3,7-dimethyloctyl)-2,4,5-tris[4-(3,7-dimethyloctyl)phenyl]-3,6-diiodo-1,1'-biphenyl
Other name (1):
  • 1,4-Diiodo-2,3,5,6-tetrakis[4-(3,7-dimethyloctyl)phenyl]benzene
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