Chem
J-GLOBAL ID：200907042003709030   Nikkaji number：J2.244.545F

2,5-Bis(octyloxy)-4-[(5-formyl-2-thienyl)ethynyl]benzaldehyde

2,5-ビス(オクチルオキシ)-4-[(5-ホルミル-2-チエニル)エチニル]ベンズアルデヒド
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： C30H40O4S
Molecular formula furigana： C30-H40-O4-S
Molecular weight： 496.710
InChI： InChI=1S/C30H40O4S/c1-3-5-7-9-11-13-19-33-29-22-26(23-31)30(34-20-14-12-10-8-6-4-2)21-25(29)15-16-27-17-18-28(24-32)35-27/h17-18,21-24H,3-14,19-20H2,1-2H3
InChI key： HHPAQUDQIZEMHF-UHFFFAOYSA-N
SMILES： CCCCCCCCOc1cc(C#Cc2ccc(C=O)s2)c(OCCCCCCCC)cc1C=O
Systematic name  (4)：
  • 2,5-ビス(オクチルオキシ)-4-[(5-ホルミル-2-チエニル)エチニル]ベンズアルデヒド
  • 5-[[2,5-ビス(オクチルオキシ)-4-ホルミルフェニル]エチニル]チオフェン-2-カルボアルデヒド
  • 5-{2-[4-ホルミル-2,5-ビス(オクチルオキシ)フェニル]エチニル}チオフェン-2-カルバルデヒド
  • 5-{2-[4-formyl-2,5-bis(octyloxy)phenyl]ethynyl}thiophene-2-carbaldehyde
Other name (2)：
  • 2,5-Bis(octyloxy)-4-[(5-formyl-2-thienyl)ethynyl]benzaldehyde
  • 5-[[2,5-Bis(octyloxy)-4-formylphenyl]ethynyl]thiophene-2-carbaldehyde
Thsaurus map：
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