Chem
J-GLOBAL ID：200907052127579873   Nikkaji number：J893.193C

1,4-Bis[(3-fluoro-4-butoxyphenyl)ethynyl]benzene

1,4-ビス[(3-フルオロ-4-ブトキシフェニル)エチニル]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： C30H28F2O2
Molecular formula furigana： C30-H28-F2-O2
Molecular weight： 458.549
InChI： InChI=1S/C30H28F2O2/c1-3-5-19-33-29-17-15-25(21-27(29)31)13-11-23-7-9-24(10-8-23)12-14-26-16-18-30(28(32)22-26)34-20-6-4-2/h7-10,15-18,21-22H,3-6,19-20H2,1-2H3
InChI key： GWAHQDDUJUAZSP-UHFFFAOYSA-N
SMILES： CCCCOc1ccc(cc1F)C#Cc1ccc(cc1)C#Cc1ccc(OCCCC)c(F)c1
Systematic name  (3)：
  • 1,4-ビス[(3-フルオロ-4-ブトキシフェニル)エチニル]ベンゼン
  • 1-ブトキシ-4-(2-{4-[2-(4-ブトキシ-3-フルオロフェニル)エチニル]フェニル}エチニル)-2-フルオロベンゼン
  • 1-butoxy-4-(2-{4-[2-(4-butoxy-3-fluorophenyl)ethynyl]phenyl}ethynyl)-2-fluorobenzene
Other name (1)：
  • 1,4-Bis[(3-fluoro-4-butoxyphenyl)ethynyl]benzene
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