Chem
J-GLOBAL ID：201407094970561190   Nikkaji number：J3.221.152F

1,4-Bis[4-(heptyloxy)phenylethynyl]benzene

1,4-ビス[4-(ヘプチルオキシ)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： C36H42O2
Molecular formula furigana： C36-H42-O2
Molecular weight： 506.730
InChI： InChI=1S/C36H42O2/c1-3-5-7-9-11-29-37-35-25-21-33(22-26-35)19-17-31-13-15-32(16-14-31)18-20-34-23-27-36(28-24-34)38-30-12-10-8-6-4-2/h13-16,21-28H,3-12,29-30H2,1-2H3
InChI key： NFCPHMUGFHYLMX-UHFFFAOYSA-N
SMILES： CCCCCCCOc1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccc(OCCCCCCC)cc1
Systematic name  (3)：
  • 1,4-ビス[4-(ヘプチルオキシ)フェニルエチニル]ベンゼン
  • 1-(ヘプチルオキシ)-4-[2-(4-{2-[4-(ヘプチルオキシ)フェニル]エチニル}フェニル)エチニル]ベンゼン
  • 1-(heptyloxy)-4-[2-(4-{2-[4-(heptyloxy)phenyl]ethynyl}phenyl)ethynyl]benzene
Other name (1)：
  • 1,4-Bis[4-(heptyloxy)phenylethynyl]benzene
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